SCHEMBL674038

SCHEMBL674038

CCCCCCCCCCCCOCCOC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[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 20)

geneUniProtsupporting neighboursconfidence
THRB known ✓ P10828 1/20 0.38
CA2 known ✓ P00918 1/20 0.36
NAAA Q02083 1/20 0.41
DGKA P23743 1/20 0.41
RECQL P46063 3/20 0.40
MAPK1 P28482 2/20 0.40
CES2 O00748 2/20 0.40
GLA P06280 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
EPHX2 P34913 1/20 0.40
BLM P54132 1/20 0.40
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 2/20 0.36
RAD52 P43351 1/20 0.36
FAAH O00519 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
Disodium Laureth Sulfosucccinate SCHEMBL27916855 1.00 NAAA (0.41) NAAADGKARECQLMAPK1CES2
SCHEMBL25166910 0.92 NAAA (0.49) NAAADGKARECQLMAPK1GLA
SCHEMBL30081498 0.92 NAAA (0.49) NAAADGKARECQLMAPK1GLA
SCHEMBL671816 0.86 RECQL (0.44) RECQLMAPK1CES2GLAHPGD
SCHEMBL8902267 0.83 ALDH1A1 (0.40) RECQLMAPK1CES2GLAHPGD
SCHEMBL5075106 0.82 NAAA (0.50) NAAADGKARECQLMAPK1GLA
SCHEMBL283124 0.82 NAAA (0.50) NAAADGKARECQLMAPK1GLA
SCHEMBL22809 0.82 NAAA (0.50) NAAADGKARECQLMAPK1GLA
SCHEMBL219917 0.82 NAAA (0.50) NAAADGKARECQLMAPK1GLA
SCHEMBL1282784 0.82 NAAA (0.50) NAAADGKARECQLMAPK1GLA

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 221 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2395966-B1 COSMETIC COMPOSITION FOR SKIN CARE LENGHEIM HUBERT (AT) 2016-07-06 EP claimed
WO-2010091827-A2 COSMETIC FORMULATION FOR SKIN CARE LENGHEIM HUBERT (AT) 2010-08-19 WO claimed
WO-2026087745-A1 AN ANTIOXIDANT COMPOSITION COMPRISING A CINNAMIC ACID DERIVATIVE BRAIN Biotech AG (DE) 2026-04-30 WO disclosed
EP-4732825-A1 AN ANTIOXIDANT COMPOSITION COMPRISING A CINNAMIC ACID DERIVATIVE BRAIN Biotech AG (DE) 2026-04-29 EP disclosed
US-20260096978-A1 A METHOD FOR PREVENTING, MITIGATING AND/OR TREATING PTGS2-INDUCED SKIN DISORDERS AND RELATED DYSFUNCTIONS SYMRISE AG (DE) 2026-04-09 US disclosed
EP-4186969-B1 SUPER-CONCENTRATED DILUTABLE POWDER FOR DISHWASHING APPLICATION HENKEL AG & CO KGAA (DE) 2026-04-01 EP disclosed
EP-4025675-B1 A PERFUME OIL MIXTURE SYMRISE AG (DE) 2026-03-18 EP disclosed
US-20260047994-A1 AN ACTIVE COMPOSITION COMPRISING RETINOL SYMRISE AG (DE) 2026-02-19 US disclosed
US-20260041094-A1 Compositions Comprising an Antimicrobial Boosting Agent SYMRISE AG (DE) 2026-02-12 US disclosed
EP-4687810-A1 PREPARATIONS COMPRISING HYDROXY PINACOLONE RETINOATE Symrise AG (DE) 2026-02-11 EP disclosed
EP-4110276-B1 COMPOSITIONS COMPRISING ALKANEDIOLS SYMRISE AG (DE) 2026-01-28 EP disclosed
WO-2010091827-A2 COSMETIC FORMULATION FOR SKIN CARE LENGHEIM HUBERT (AT) 2010-08-19 WO disclosed
EP-1465491-B1 ANTISEPTIC COMPOSITIONS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2009-01-21 EP disclosed
EP-1955594-A1 Antiseptic compositions and methods 3M Innovative Properties Company (US) 2008-08-13 EP disclosed
US-7323163-B2 Film-forming compositions and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-01-29 US disclosed
EP-1849487-A2 Film-forming compositions and methods 3M Innovative Properties Company (US) 2007-10-31 EP disclosed
EP-1465676-B1 FILM-FORMING COMPOSITIONS AND THEIR USES 3M INNOVATIVE PROPERTIES CO (US) 2007-08-15 EP disclosed
US-7147873-B2 I2 and/or an iodophor to provide an available iodine concentration of at least 0.25 wt-%; a hydroxycarboxylic acid buffer; water; and a substantive film-forming polymer. 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-12-12 US disclosed
US-20050025794-A1 Film-forming compositions and methods 3M INNOVATIVE PROPERTIES COMPANY 2005-02-03 US disclosed
US-6838078-B2 Film-forming compositions and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-01-04 US 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 (4 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-20260041094-A1 Compositions Comprising an Antimicrobial Boosting Agent TLR7, MYC, ERG28 THRB 1828/4885CA2 4525/4885NAAA 1798/4885
US-20260047994-A1 AN ACTIVE COMPOSITION COMPRISING RETINOL RBP4, LRAT, RARB THRB 82/4885CA2 1876/4885NAAA 3100/4885
US-20050025794-A1 Film-forming compositions and methods VCL, PUF60, PHOSPHO1 THRB 4445/4885CA2 4036/4885NAAA 67/4885
US-20260096978-A1 A METHOD FOR PREVENTING, MITIGATING AND/OR TREATING PTGS2-INDUCED SKIN DISORDERS AND RELATED DYSFUNCTIONS PTGS2, PTGES2, PTGS1 THRB 2049/4885CA2 332/4885NAAA 2012/4885

“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.