Stearic Acid

Stearic Acid

SCHEMBL8846997

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

nearest known ligand 0.77

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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 0.77
PPARG P37231 7/20 0.77
PPARD Q03181 7/20 0.77
PPARA Q07869 7/20 0.77
HDAC11 Q96DB2 5/20 0.77
TSHR P16473 4/20 0.77
PTPN1 P18031 3/20 0.77
FABP4 P15090 3/20 0.77
ALDH1A1 P00352 2/20 0.77
TLR2 O60603 2/20 0.77
TDP1 Q9NUW8 2/20 0.77
KMT2A Q03164 2/20 0.77
ALOX15 P16050 2/20 0.77
HSD17B10 Q99714 2/20 0.77
SLC22A6 Q4U2R8 1/20 0.77
SLC22A8 Q8TCC7 1/20 0.77
MEN1 O00255 1/20 0.77
ESR1 P03372 1/20 0.77
PDE4A P27815 1/20 0.77
PDE3A Q14432 1/20 0.77

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
Dodecanoate SCHEMBL10577874 0.93 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL28272567 0.91 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Hexanoate SCHEMBL28788428 0.91 AKR1B1 (0.80) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL1011338 0.90 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL11697627 0.90 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL31633222 0.88 GPR84 (0.90) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL10595500 0.88 GPR84 (0.90) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL23649545 0.88 GPR84 (1.00) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL25287435 0.88 GPR84 (1.00) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL25293218 0.88 GPR84 (1.00) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0605831-B1 Filler-containing resin composition and stretched films using same MITSUBISHI CHEM CORP (JP) 1997-10-15 EP disclosed
US-5385972-A For waterproofing films having good elastic recovery, strength and gas permeability MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1995-01-31 US disclosed
EP-0605831-A1 Filler-containing resin composition and stretched films using same MITSUBISHI CHEMICAL CORPORATION (JP) 1994-07-13 EP disclosed
US-5126391-A Ethylene copolymer with olefin or diolefin, with glyceride of hydroxy aliphatic acid additive, tear strength MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1992-06-30 US disclosed
EP-0459142-A2 Filler-containing stretched film MITSUBISHI CHEMICAL CORPORATION (JP) 1991-12-04 EP disclosed