Stearic Acid

Stearic Acid

SCHEMBL9813592

CC1CC(C)(C)N(Cc2ccccc2)C(C)(C)C1.CCCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.44

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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
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
ABL1 P00519 1/20 0.43
RIN1 Q13671 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
EPHX2 P34913 1/20 0.42
GPR84 Q9NQS5 7/20 0.41
PPARG P37231 6/20 0.41
PPARD Q03181 6/20 0.41
PPARA Q07869 6/20 0.41
HDAC11 Q96DB2 5/20 0.41
TSHR P16473 4/20 0.41
TLR2 O60603 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FABP4 P15090 2/20 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
Sebacic Acid SCHEMBL9813717 0.95 MAPT (0.46) ALDH1A1MAPTLMNAHTTABL1
SCHEMBL11166300 0.82 MAPT (0.44) MAPTABL1RIN1RXFP1HDAC11
Hexanoate SCHEMBL9813711 0.79 AKR1B1 (0.48) ALDH1A1MAPTHSD17B10LMNAGPR84
Stearic Acid SCHEMBL9813639 0.77 GPR84 (0.53) ALDH1A1MAPTHSD17B10GPR84PPARG
Stearic Acid SCHEMBL9813605 0.76 GPR84 (0.45) ALDH1A1MAPTHSD17B10LMNAGPR84
SCHEMBL11630105 0.76 LTB4R (0.39) ALDH1A1MAPTRXFP1PPARGPPARA
Palmitic Acid SCHEMBL9813707 0.75 GPR84 (0.44) ALDH1A1HSD17B10EPHX2GPR84PPARG
Stearic Acid SCHEMBL9813649 0.75 GPR84 (0.44) ALDH1A1MAPTHSD17B10LMNAGPR84
SCHEMBL9243231 0.75 KMT2A (0.43) ALDH1A1MAPTKDM4EHPGDHTT
SCHEMBL11169359 0.73 NPC1 (0.39) ALDH1A1HPGDMEN1KMT2A

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