SCHEMBL718013

SCHEMBL718013

O=C([O-])CCCCC(=S)CC=S.[Na+]

nearest known ligand 0.41

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 1/20 0.41
FABP3 P05413 9/20 0.37
HDAC3 O15379 2/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC8 Q9BY41 2/20 0.34
FFAR3 O14843 1/20 0.34
HDAC4 P56524 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
NFKB1 P19838 1/20 0.32
BBOX1 O75936 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Dihydrolipoic Acid SCHEMBL715539 0.83 NFKB1 (0.33) CA1NFKB1
SCHEMBL7054829 0.74 FABP3 (0.53) CA1FABP3HDAC3HDAC1HDAC2
Adipic Acid SCHEMBL107905 0.74 CA1 (0.67) CA1FABP3HDAC3HDAC1HDAC2
SCHEMBL5696140 0.71
Sebacic Acid SCHEMBL306520 0.71 CA1 (0.63) CA1FABP3HDAC3HDAC1HDAC2
SCHEMBL11046980 0.71 CA1 (0.63) CA1FABP3HDAC3HDAC1HDAC2
SCHEMBL6053545 0.71 CA1 (0.63) CA1FABP3HDAC3HDAC1HDAC2
SCHEMBL20577558 0.71 CA1 (0.63) CA1FABP3HDAC3HDAC1HDAC2
SCHEMBL8325989 0.71 CA1 (0.63) CA1FABP3HDAC3HDAC1HDAC2
Octanedioate SCHEMBL188028 0.71 CA1 (0.63) CA1FABP3HDAC3HDAC1HDAC2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 78 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9795558-B2 Depilatory formulations and methods of using same RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2017-10-24 US claimed
US-9573001-B2 Depilatory composition RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2017-02-21 US claimed
EP-2155808-B1 METHOD FOR TREATING THE SURFACE OF A SUBSTRATE BASED ON SULPHUR POLYMER, INTENDED TO BE COVERED WITH A COATING ESSILOR INT (COMPAGNIE GÉNÉRALE D'OPTIQUE) (FR) 2016-12-14 EP claimed
US-9110223-B2 Method for treating the surface of a substrate based on sulphur polymer, intended to be covered with a coating ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2015-08-18 US claimed
US-20150202140-A1 Depilatory Formulations And Methods Of Using Same RECKITT & COLMAN (OVERSEAS) HEALTH LIMITED (GB) 2015-07-23 US claimed
EP-2355788-B1 DEPILATORY COMPOSITION RECKITT & COLMAN OVERSEAS (GB) 2014-02-12 EP claimed
JP-2010529275-A 2010-08-26 JP claimed
US-20100189889-A1 Method for Treating the Surface of a Substrate Based on Sulphur Polymer, Intended to be Covered with a Coating ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2010-07-29 US claimed
EP-2155808-A1 METHOD FOR TREATING THE SURFACE OF A SUBSTRATE BASED ON SULPHUR POLYMER, INTENDED TO BE COVERED WITH A COATING Essilor International (Compagnie Générale D'Optique) (FR) 2010-02-24 EP claimed
US-20100028392-A1 Personal Care Article RECKITT BENCKISER (UK) LIMITED (GB) 2010-02-04 US claimed
EP-2010128-A1 PERSONAL CARE ARTICLE Reckitt Benckiser Healthcare (UK) Limited (GB) 2009-01-07 EP claimed
US-20090004128-A1 Non-Irritant Rapid-Action Dipilatory Composition PRODUCCIONES INFOVISION (MX) 2009-01-01 US claimed
WO-2008155507-A1 METHOD FOR TREATING THE SURFACE OF A SUBSTRATE BASED ON SULPHUR POLYMER, INTENDED TO BE COVERED WITH A COATING ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2008-12-24 WO claimed
US-20080260671-A1 Depilatory Compositions RECKITT BENCKISER (UK) LIMITED (GB) 2008-10-23 US claimed
WO-2007128983-A1 PERSONAL CARE ARTICLE RECKITT BENCKISER (UK) LIMITED (GB) 2007-11-15 WO claimed
EP-1001735-B1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE RECKITT BENCKISER FRANCE (FR) 2003-03-19 EP claimed
US-6306380-B1 FOR REMOVING UNWANTED BODY HAIR RECKITT & COLMAN FRANCE (FR) 2001-10-23 US claimed
EP-1001735-A1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE Reckitt & Colman France (FR) 2000-05-24 EP claimed
WO-1999002125-A1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE RECKITT & COLMAN FRANCE (FR) 1999-01-21 WO claimed
EP-2879762-B1 NOVEL DEPILATORY PRODUCT RECKITT & COLMAN OVERSEAS HEALTH LTD (GB) 2019-11-20 EP disclosed
EP-3348250-A1 DEPILATORY COMPOSITION Reckitt & Colman (Overseas) Limited (GB) 2018-07-18 EP disclosed
EP-2844351-B1 NOVEL DEPILATORY COMPOSITIONS RECKITT & COLMAN OVERSEAS (GB) 2018-05-23 EP disclosed
US-9974735-B2 Depilatory compositions RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2018-05-22 US disclosed
US-9795558-B2 Depilatory formulations and methods of using same RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2017-10-24 US disclosed
US-20170224610-A1 Depilatory Compositions RECKITT & COLMAN (OVERSEAS) HEALTH LIMITED (GB) 2017-08-10 US disclosed
US-9573001-B2 Depilatory composition RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2017-02-21 US disclosed
EP-2155808-B1 METHOD FOR TREATING THE SURFACE OF A SUBSTRATE BASED ON SULPHUR POLYMER, INTENDED TO BE COVERED WITH A COATING ESSILOR INT (COMPAGNIE GÉNÉRALE D'OPTIQUE) (FR) 2016-12-14 EP disclosed
US-9205037-B2 Single phase depilatory composition CHURCH & DWIGHT CO., INC. (US) 2015-12-08 US disclosed
US-9110223-B2 Method for treating the surface of a substrate based on sulphur polymer, intended to be covered with a coating ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2015-08-18 US disclosed
US-20150202140-A1 Depilatory Formulations And Methods Of Using Same RECKITT & COLMAN (OVERSEAS) HEALTH LIMITED (GB) 2015-07-23 US disclosed
EP-2879762-A1 NOVEL DEPILATORY PRODUCT Reckitt & Colman (Overseas) Limited (GB) 2015-06-10 EP disclosed
US-20150113741-A1 HAIR REMOVAL COMPOSITIONS RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2015-04-30 US disclosed
US-20150074923-A1 DEPILATORY COMPOSITIONS RECKITT & COLEMAN (OVERSEAS) LIMITED (GB) 2015-03-19 US disclosed
EP-2844351-A2 NOVEL DEPILATORY COMPOSITIONS Reckitt & Colman (Overseas) Limited (GB) 2015-03-11 EP disclosed
US-20140215726-A1 DEPILATORY COMPOSITIONS RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2014-08-07 US disclosed
US-20140170246-A1 Topical Composition RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2014-06-19 US disclosed
WO-2014080015-A2 HAIR GROWTH COMPOSITIONS AND METHODS PILOSCIENCES (FR) 2014-05-30 WO disclosed
EP-2735303-A1 Hair growth compositions and methods Pilosciences (FR) 2014-05-28 EP disclosed
US-8709098-B2 Depilatory composition RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2014-04-29 US disclosed
US-8658222-B2 Topical composition RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2014-02-25 US disclosed
WO-2014020352-A1 NOVEL DEPILATORY PRODUCT RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2014-02-06 WO disclosed
WO-2013160689-A2 NOVEL DEPILATORY COMPOSITIONS RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2013-10-31 WO disclosed
US-8524207-B2 Cosmetic compositions RECKITT BENCKISER (UK) LIMITED (GB) 2013-09-03 US disclosed
US-20130022568-A1 SINGLE PHASE DEPILATORY COMPOSITION CHURCH & DWIGHT CO., INC. (US) 2013-01-24 US disclosed
US-20120052035-A1 Two Phase Depilatory Composition CHURCH & DWIGHT CO., INC. 2012-03-01 US disclosed
EP-2387441-A2 TOPICAL COMPOSITION Reckitt & Colman (Overseas) Limited (GB) 2011-11-23 EP disclosed
US-8040465-B2 External light illumination of display screens APPLE INC. (US) 2011-10-18 US disclosed
EP-2355788-A2 DEPILATORY COMPOSITION Reckitt & Colman (Overseas) Limited (GB) 2011-08-17 EP disclosed
US-20100189889-A1 Method for Treating the Surface of a Substrate Based on Sulphur Polymer, Intended to be Covered with a Coating ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2010-07-29 US disclosed
WO-2010082024-A2 TOPICAL COMPOSITION RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2010-07-22 WO disclosed
WO-2010064017-A2 DEPILATORY COMPOSITION RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2010-06-10 WO disclosed
US-20100083443-A1 Depilatory Composition RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2010-04-08 US disclosed
EP-2155808-A1 METHOD FOR TREATING THE SURFACE OF A SUBSTRATE BASED ON SULPHUR POLYMER, INTENDED TO BE COVERED WITH A COATING Essilor International (Compagnie Générale D'Optique) (FR) 2010-02-24 EP disclosed
US-20100028392-A1 Personal Care Article RECKITT BENCKISER (UK) LIMITED (GB) 2010-02-04 US disclosed
EP-2120848-A2 DEPILATORY COMPOSITION Reckitt Benckiser (UK) Limited (GB) 2009-11-25 EP disclosed
US-20090158595-A1 Microemulsion and Shaving Apparatus Comprising a Microemulsion RECKITT BENCKISER (UK) LIMITED (GB) 2009-06-25 US disclosed
US-20090117068-A1 COSMETIC COMPOSITIONS RECKITT & BENCKISER (UK) LIMITED (GB) 2009-05-07 US disclosed
EP-2010128-A1 PERSONAL CARE ARTICLE Reckitt Benckiser Healthcare (UK) Limited (GB) 2009-01-07 EP disclosed
US-20090004128-A1 Non-Irritant Rapid-Action Dipilatory Composition PRODUCCIONES INFOVISION (MX) 2009-01-01 US disclosed
WO-2008155507-A1 METHOD FOR TREATING THE SURFACE OF A SUBSTRATE BASED ON SULPHUR POLYMER, INTENDED TO BE COVERED WITH A COATING ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2008-12-24 WO disclosed
WO-2008110745-A2 DEPILATORY COMPOSITION RECKITT BENCKISER (UK) LIMITED (GB) 2008-09-18 WO disclosed
EP-1948121-A1 MICROEMULSION AND SHAVING APPARATUS COMPRISING A MICROEMULSION Reckitt Benckiser (UK) LIMITED (GB) 2008-07-30 EP disclosed
EP-1937364-A2 IMPROVEMENTS IN OR RELATIMG TO COSMETIC COMPOSITIONS Reckitt Benckiser (UK) Limited (GB) 2008-07-02 EP disclosed
WO-2007128983-A1 PERSONAL CARE ARTICLE RECKITT BENCKISER (UK) LIMITED (GB) 2007-11-15 WO disclosed
US-20070248563-A1 Skin care compositions including marine extracts GILLETTE COMPANY, THE 2007-10-25 US disclosed
WO-2007119227-A2 SKIN CARE COMPOSITIONS INCLUDING MARINE EXTRACTS THE GILLETTE COMPANY (US) 2007-10-25 WO disclosed
WO-2007042824-A1 MICROEMULSION AND SHAVING APPARATUS COMPRISING A MICROEMULSION RECKITT BENCKISER (UK) LIMITED (GB) 2007-04-19 WO disclosed
WO-2007031793-A2 IMPROVEMENTS IN OR RELATIMG TO COSMETIC COMPOSITIONS RECKITT BENCKISER (UK) LIMITED (GB) 2007-03-22 WO disclosed
EP-1660187-A1 METHOD AND KIT FOR REDUCING IRRITATION OF SKIN DELIPATORY COMPOSITIONS UNILEVER PLC (GB) 2006-05-31 EP disclosed
US-20060002878-A1 Cosmetic article and related methods RECKITT BENCKISER (UK) LIMITED (GB) 2006-01-05 US disclosed
EP-1551250-A1 COSMETIC ARTICLE AND RELATED METHODS Reckitt Benckiser (UK) LIMITED (GB) 2005-07-13 EP disclosed
WO-2004096164-A1 METHOD AND KIT FOR REDUCING IRRITATION OF SKIN DELIPATORY COMPOSITIONS UNILEVER PLC (GB) 2004-11-11 WO disclosed
US-20040219118-A1 Method and kit for reducing irritation of skin depilatory compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-11-04 US disclosed
WO-2004014179-A1 COSMETIC ARTICLE AND RELATED METHODS RECKITT BENCKISER (UK) LIMITED (GB) 2004-02-19 WO disclosed
EP-1001735-B1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE RECKITT BENCKISER FRANCE (FR) 2003-03-19 EP disclosed
US-6306380-B1 FOR REMOVING UNWANTED BODY HAIR RECKITT & COLMAN FRANCE (FR) 2001-10-23 US disclosed
EP-1001735-A1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE Reckitt & Colman France (FR) 2000-05-24 EP disclosed
WO-1999002125-A1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE RECKITT & COLMAN FRANCE (FR) 1999-01-21 WO disclosed
WO-1999002125-A1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE RECKITT & COLMAN FRANCE (FR) 1999-01-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080260671-A1 Depilatory Compositions TYR, NQO1, COMT CA1 3338/4885FABP3 2320/4885HDAC3 517/4885
US-20120052035-A1 Two Phase Depilatory Composition DEPTOR, PARG, PARN CA1 3364/4885FABP3 4371/4885HDAC3 15/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.