Stearic Acid

Stearic Acid

SCHEMBL7028397

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

nearest known ligand 0.74

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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
CA2 P00918 1/20 0.74
MAPK1 P28482 1/20 0.74
GPR84 Q9NQS5 7/20 0.63
PPARG P37231 7/20 0.63
PPARD Q03181 7/20 0.63
PPARA Q07869 7/20 0.63
HDAC11 Q96DB2 5/20 0.63
TSHR P16473 4/20 0.63
PTPN1 P18031 3/20 0.63
ALDH1A1 P00352 2/20 0.63
TLR2 O60603 2/20 0.63
TDP1 Q9NUW8 2/20 0.63
FABP4 P15090 2/20 0.63
FFAR1 O14842 2/20 0.63
FFAR4 Q5NUL3 2/20 0.63
KMT2A Q03164 2/20 0.63
SLC22A6 Q4U2R8 1/20 0.63
SLC22A8 Q8TCC7 1/20 0.63
MEN1 O00255 1/20 0.63
ESR1 P03372 1/20 0.63

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
2-Ethylhexanoic Acid SCHEMBL3127804 1.00 CA2 (0.74) CA2MAPK1GPR84PPARGPPARD
2-Ethylhexanoic Acid SCHEMBL28500508 1.00 CA2 (0.74) CA2MAPK1GPR84PPARGPPARD
2-Ethylhexanoic Acid SCHEMBL18009668 1.00 CA2 (0.74) CA2MAPK1GPR84PPARGPPARD
Stearic Acid SCHEMBL2585578 1.00 CA2 (0.74) CA2MAPK1GPR84PPARGPPARD
Palmitic Acid SCHEMBL633826 1.00 CA2 (0.74) CA2MAPK1GPR84PPARGPPARD
Myristic Acid SCHEMBL28575932 1.00 CA2 (0.74) CA2MAPK1GPR84PPARGPPARD
Stearic Acid SCHEMBL3442014 1.00 CA2 (0.74) CA2MAPK1GPR84PPARGPPARD
Behenic Acid SCHEMBL6871644 1.00 CA2 (0.74) CA2MAPK1GPR84PPARGPPARD
2-Ethylhexanoic Acid SCHEMBL320959 0.98 CA2 (0.71) CA2MAPK1GPR84PPARGPPARD
2-Ethylhexanoic Acid SCHEMBL2429690 0.98 CA2 (0.77) CA2MAPK1GPR84PPARGPPARD

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-0736545-B1 Dextrin ester of fatty acids and use thereof CHIBA FLOUR MILLING (JP) 2003-01-22 EP disclosed
US-5840883-A COSMETICS, DRUGS, COATING OR INK BASE CHIBA FLOUR MILLING CO., LTD. (JP) 1998-11-24 US disclosed
EP-0736545-A2 Dextrin ester of fatty acids and use thereof Chiba Flour Milling Co., Ltd. (JP) 1996-10-09 EP disclosed