Stearic Acid

Stearic Acid

SCHEMBL630649

CC(O)COC(C)COC(C)CO.CCCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.50

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Known targets — ChEMBL curated mechanism

rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Stearic Acid. 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
GPR84 Q9NQS5 7/20 0.50
PPARG P37231 7/20 0.50
PPARD Q03181 7/20 0.50
PPARA Q07869 7/20 0.50
HDAC11 Q96DB2 5/20 0.50
TSHR P16473 4/20 0.50
PTPN1 P18031 3/20 0.50
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TLR2 O60603 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
FABP4 P15090 2/20 0.50
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 2/20 0.50
MAPT P10636 2/20 0.50
MEN1 O00255 2/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
ESR1 P03372 1/20 0.50
ALOX15 P16050 1/20 0.50

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
Heptanoate SCHEMBL27561694 1.00 GPR84 (0.50) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL10673544 1.00 GPR84 (0.50) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL29242729 1.00 GPR84 (0.50) GPR84PPARGPPARDPPARAHDAC11
Myristic Acid SCHEMBL29002739 1.00 GPR84 (0.50) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL10674387 1.00 GPR84 (0.50) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL1641106 1.00 GPR84 (0.50) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL323989 0.97 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Azelaic Acid SCHEMBL7852023 0.97 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Pentadecanoic Acid SCHEMBL17668919 0.97 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL15665264 0.97 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1148863-B2 DETERGENT COSMETIC COMPOSITIONS AND USE OREAL (FR) 2012-02-22 EP claimed
CN-1161093-C Detergent cosmetic compositions and use �ź㴫 2004-08-11 CN claimed
EP-1148863-B1 DETERGENT COSMETIC COMPOSITIONS AND USE OREAL (FR) 2002-06-26 EP claimed
CN-1338920-A Detergent cosmetic compositions and use OREAL (FR) 2002-03-06 CN claimed
CN-1161093-C Detergent cosmetic compositions and use �ź㴫 2004-08-11 CN disclosed
CN-1338920-A Detergent cosmetic compositions and use OREAL (FR) 2002-03-06 CN disclosed
CN-1005060-B Transparent polyvinyl chloride products and compositions B·F古德里奇公司 1989-08-30 CN disclosed
US-4751118-A CONTAINING AN ETHER STABILIZER THE B. F. GOODRICH COMPANY (US) 1988-06-14 US disclosed
CN-86105440-A Transparent polyvinyl chloride products and compositions 1987-05-27 CN disclosed
EP-0212648-A2 Clear polyvinyl chloride articles and compositions The B.F. GOODRICH Company (US) 1987-03-04 EP disclosed
US-4399075-A Process for producing chlorinated phenoxytoluene derivatives ASAHI CHEMICAL COMPANY, LIMITED (JP) 1983-08-16 US disclosed