Stearic Acid

Stearic Acid

SCHEMBL11077205

CCCCCCCCCCCCCCCCCC(=O)O.OCCO.OCCO.OCCO

nearest known ligand 0.85

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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 0.85
PPARG P37231 7/20 0.85
PPARD Q03181 7/20 0.85
PPARA Q07869 7/20 0.85
HDAC11 Q96DB2 5/20 0.85
TSHR P16473 4/20 0.85
PTPN1 P18031 3/20 0.85
FABP4 P15090 3/20 0.85
ALDH1A1 P00352 2/20 0.85
TLR2 O60603 2/20 0.85
TDP1 Q9NUW8 2/20 0.85
KMT2A Q03164 2/20 0.85
ALOX15 P16050 2/20 0.85
HSD17B10 Q99714 2/20 0.85
SLC22A6 Q4U2R8 1/20 0.85
SLC22A8 Q8TCC7 1/20 0.85
MEN1 O00255 1/20 0.85
ESR1 P03372 1/20 0.85
PDE4A P27815 1/20 0.85
PDE3A Q14432 1/20 0.85

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
Octanoic Acid SCHEMBL873761 1.00 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL6066257 1.00 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL4929080 1.00 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL1275148 1.00 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL4204219 1.00 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Sebacic Acid SCHEMBL11510695 1.00 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL18076283 1.00 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL43379 1.00 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL17812647 1.00 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL8161929 1.00 GPR84 (0.85) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4437919-A POLYISOCYANATE, ENDCAPPED POLYETHERSILOXANE FIBER INDUSTRIES, INC. (US) 1984-03-20 US disclosed
US-4201803-A CHAIN EXTENDED POLYURETHANE, AMINO RESIN AMERICAN CYANAMID COMPANY (US) 1980-05-06 US disclosed