Stearic Acid

Stearic Acid

SCHEMBL4897146

CCC(O)C(=O)O.CCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.68

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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 0.68
PPARG P37231 7/20 0.68
PPARD Q03181 7/20 0.68
PPARA Q07869 7/20 0.68
HDAC11 Q96DB2 5/20 0.68
TSHR P16473 4/20 0.68
PTPN1 P18031 3/20 0.68
ALDH1A1 P00352 2/20 0.68
TLR2 O60603 2/20 0.68
TDP1 Q9NUW8 2/20 0.68
FABP4 P15090 2/20 0.68
FFAR1 O14842 2/20 0.68
FFAR4 Q5NUL3 2/20 0.68
SLC22A6 Q4U2R8 1/20 0.68
SLC22A8 Q8TCC7 1/20 0.68
MEN1 O00255 1/20 0.68
ESR1 P03372 1/20 0.68
ALOX15 P16050 1/20 0.68
PDE4A P27815 1/20 0.68
KMT2A Q03164 1/20 0.68

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
Stearic Acid SCHEMBL725460 1.00 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL726992 1.00 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL17200974 1.00 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL725759 1.00 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL725458 1.00 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL727170 1.00 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL726990 1.00 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Hexanoate SCHEMBL585328 0.98 AKR1B1 (0.67) GPR84PPARGPPARDPPARAHDAC11
Valeric Acid SCHEMBL29915 0.92 AKR1B1 (0.56) GPR84PPARGPPARDPPARAHDAC11
Oleic Acid SCHEMBL14782679 0.90 PPARG (0.74) PPARGPPARDPPARATSHRPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080188593-A1 Biodegradable Aliphatic-Aromatic Polyester NOVAMONT S.P.A. (IT) 2008-08-07 US claimed