SCHEMBL160232

SCHEMBL160232

O=C([O-])C(O)(Cl)CO.O=C([O-])C(O)(Cl)CO.O=C([O-])C(O)(Cl)CO.O=C([O-])C(O)(Cl)CO.[Al+3].[Na+]

nearest known ligand 0.46

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 1)

geneUniProtsupporting neighboursconfidence
CA4 known ✓ P22748 3/20 0.39

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
SCHEMBL932763 0.97 CA4 (0.35) CA4
SCHEMBL5354730 0.97
SCHEMBL344580 0.95 CA4 (0.33) CA4
SCHEMBL29670042 0.74
SCHEMBL25196181 0.69 CA4 (0.57) CA4
SCHEMBL1495773 0.69
SCHEMBL5714066 0.69 CA4 (0.42) CA4
Trichloroacetic Acid SCHEMBL60578 0.66
Trichloroacetic Acid SCHEMBL10755500 0.66 ALDH1A1 (0.47) CA4
Trichloroacetic Acid SCHEMBL465138 0.66 ALDH1A1 (0.47) CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10869817-B2 Antiperspirant stick compositions Henkel IP & Holding GmbH 2020-12-22 US claimed
US-10835483-B2 Antiperspirant stick compositions Henkel IP & Holding GmbH 2020-11-17 US claimed
US-10821068-B2 Antiperspirant stick compositions Henkel IP & Holding GmbH (DE) 2020-11-03 US claimed
EP-3694473-A1 ANTIPERSPIRANT STICK COMPOSITIONS Henkel IP & Holding GmbH (DE) 2020-08-19 EP claimed
WO-2019074647-A1 ANTIPERSPIRANT STICK COMPOSITIONS Henkel IP & Holding GmbH (DE) 2019-04-18 WO claimed
WO-2019074643-A1 ANTIPERSPIRANT STICK COMPOSITIONS Henkel IP & Holding GmbH (DE) 2019-04-18 WO claimed
US-20190105239-A1 ANTIPERSPIRANT STICK COMPOSITIONS Henkel IP & Holding GmbH (DE) 2019-04-11 US claimed
US-20190105255-A1 ANTIPERSPIRANT STICK COMPOSITIONS Henkel IP & Holding GmbH (DE) 2019-04-11 US claimed
US-20190105257-A1 ANTIPERSPIRANT STICK COMPOSITIONS Henkel IP & Holding GmbH (DE) 2019-04-11 US claimed
US-20190105256-A1 ANTIPERSPIRANT STICK COMPOSITIONS Henkel IP & Holding GmbH (DE) 2019-04-11 US claimed
WO-2015055198-A1 COSMETIC ANTIPERSPIRANTS WITH AROMATIC SULPHONIC ACIDS HENKEL AG & CO. KGAA (DE) 2015-04-23 WO claimed
WO-2015055184-A1 COSMETIC ANTIPERSPIRANTS WITH LACTATES HENKEL AG & CO. KGAA (DE) 2015-04-23 WO claimed
EP-1185238-B1 DEODORANT COMPOSITIONS CONTAINING CYCLODEXTRIN ODOR CONTROLLING AGENTS PROCTER & GAMBLE (US) 2005-10-19 EP claimed
EP-0972512-B1 Cosmetic composition containing pigments, an antiperspirant and a solid elastomeric partially crosslinked organopolysiloxane, use of such a composition OREAL (FR) 2002-01-02 EP claimed
US-6251412-B1 USE IN MAKE-UP, TO IMPROVE THE STAYING POWER OF THE COLOR OF THE COMPOSITION L'OREAL (FR) 2001-06-26 US claimed
EP-0972509-A1 Cosmetic composition containing pigments and antiperspirant agents, use of such a composition L'OREAL (FR) 2000-01-19 EP claimed
EP-0972512-A1 Cosmetic composition containing pigments, an antiperspirant and a solid elastomeric partially crosslinked organopolysiloxane, use of such a composition L'OREAL (FR) 2000-01-19 EP claimed
EP-0318206-A1 Deodorant gel stick THE PROCTER & GAMBLE COMPANY (US) 1989-05-31 EP claimed
US-4816261-A Deodorant gel stick THE PROCTER & GAMBLE COMPANY (US) 1989-03-28 US claimed
US-4781917-A FREE OF UNBOUND WATER THE PROCTOR & GAMBLE COMPANY (US) 1988-11-01 US claimed