Stearic Acid

Stearic Acid

SCHEMBL9813677

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)OCCN1C(C)(C)CC(C)CC1(C)C

nearest known ligand 0.48

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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
DGKA P23743 1/20 0.48
PAM P19021 2/20 0.44
EPHX2 P34913 2/20 0.44
DNM1 Q05193 1/20 0.42
GPR84 Q9NQS5 7/20 0.41
PPARG P37231 7/20 0.41
PPARD Q03181 7/20 0.41
PPARA Q07869 7/20 0.41
HDAC11 Q96DB2 5/20 0.41
TSHR P16473 4/20 0.41
PTPN1 P18031 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TLR2 O60603 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FABP4 P15090 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
MEN1 O00255 1/20 0.41
ESR1 P03372 1/20 0.41
ALOX15 P16050 1/20 0.41

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
Palmitic Acid SCHEMBL9813707 0.88 GPR84 (0.44) EPHX2GPR84PPARGPPARDPPARA
SCHEMBL9092669 0.85 DGKA (0.53) DGKAPAMEPHX2DNM1TSHR
Hexanoate SCHEMBL9813711 0.84 AKR1B1 (0.48) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL16371992 0.82 NAAA (0.50) DGKAPAMEPHX2DNM1TSHR
SCHEMBL16371601 0.82 NAAA (0.50) DGKAPAMEPHX2DNM1TSHR
SCHEMBL17830165 0.82 NAAA (0.50) DGKAPAMEPHX2DNM1TSHR
SCHEMBL17830162 0.82 NAAA (0.50) DGKAPAMEPHX2DNM1TSHR
SCHEMBL16372121 0.81 NAAA (0.48) DGKAPAMEPHX2DNM1
Stearic Acid SCHEMBL9813639 0.80 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL11154148 0.79 DGKA (0.56) DGKAPAMEPHX2DNM1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0163245-B1 DERIVATIVES OF ALKYL-SUBSTITUTED 4-HYDROXY-METHYL-PIPERIDINE AND USE THEREOF AS STABILIZERS AUSIMONT S.r.l. (IT) 1991-07-31 EP disclosed
US-4772708-A STABILIZERS FOR POLYMERS AUSIMONT S.P.A. (IT) 1988-09-20 US disclosed
EP-0163245-A2 Derivatives of alkyl-substituted 4-hydroxy-methyl-piperidine and use thereof as stabilizers AUSIMONT S.r.l. (IT) 1985-12-04 EP disclosed