Stearic Acid

Stearic Acid

SCHEMBL27646266

CCCCCCCCCCCCCCCCCC(=O)O.O=C(O)c1ccc(O)cc1

nearest known ligand 0.67

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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
HSD17B3 P37058 6/20 0.67
GPR84 Q9NQS5 7/20 0.59
PPARG P37231 7/20 0.59
PPARD Q03181 7/20 0.59
PPARA Q07869 7/20 0.59
HDAC11 Q96DB2 5/20 0.59
TSHR P16473 4/20 0.59
PTPN1 P18031 3/20 0.59
ALDH1A1 P00352 2/20 0.59
TLR2 O60603 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
FABP4 P15090 2/20 0.59
SLC22A6 Q4U2R8 1/20 0.59
SLC22A8 Q8TCC7 1/20 0.59
MEN1 O00255 1/20 0.59
ESR1 P03372 1/20 0.59
ALOX15 P16050 1/20 0.59
PDE4A P27815 1/20 0.59
KMT2A Q03164 1/20 0.59
PDE3A Q14432 1/20 0.59

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
Decanoic Acid SCHEMBL28853577 1.00 HSD17B3 (0.67) HSD17B3GPR84PPARGPPARDPPARA
Myristic Acid SCHEMBL1615180 1.00 HSD17B3 (0.67) HSD17B3GPR84PPARGPPARDPPARA
Paraben SCHEMBL27754690 0.98 HSD17B3 (0.66) HSD17B3GPR84PPARGPPARDPPARA
Stearic Acid SCHEMBL8445561 0.93 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Behenic Acid SCHEMBL22655274 0.93 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL8446001 0.91 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL28026106 0.91 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL10939868 0.91 GPR84 (0.71) HSD17B3GPR84PPARGPPARDPPARA
Palmitic Acid SCHEMBL10942082 0.91 GPR84 (0.71) HSD17B3GPR84PPARGPPARDPPARA
Octanoic Acid SCHEMBL10937199 0.91 GPR84 (0.71) HSD17B3GPR84PPARGPPARDPPARA

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
CN-101798488-A Heat-sensitive adhesive material RICOH KK 2010-08-11 CN disclosed
CN-100589973-C Heat-sensitive adhesive material RICOH CO LTD 2010-02-17 CN disclosed
CN-1769360-A Heat-sensitive adhesive material RICOH KK (JP) 2006-05-10 CN disclosed