Stearic Acid

Stearic Acid

SCHEMBL8129284

CCCCC(CC)C(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].O=[Al+].O=[Al+]

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 6)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.68
FABP3 P05413 6/20 0.50
NFKB1 P19838 1/20 0.49
GPR84 Q9NQS5 1/20 0.47
MAPK1 P28482 1/20 0.47
CA1 P00915 1/20 0.47

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 SCHEMBL29893966 0.95 CA2 (0.70) CA2FABP3NFKB1GPR84MAPK1
Stearic Acid SCHEMBL8665090 0.95 CA2 (0.70) CA2FABP3NFKB1GPR84MAPK1
2-Ethylhexanoic Acid SCHEMBL9222984 0.95 CA2 (0.76) CA2FABP3NFKB1GPR84MAPK1
2-Ethylhexanoic Acid SCHEMBL31503113 0.95 CA2 (0.70) CA2FABP3NFKB1GPR84MAPK1
Stearic Acid SCHEMBL17707712 0.95 CA2 (0.70) CA2FABP3NFKB1GPR84MAPK1
Sebacic Acid SCHEMBL8747721 0.93 CA2 (0.72) CA2FABP3NFKB1GPR84MAPK1
2-Ethylhexanoic Acid SCHEMBL6328306 0.93 CA2 (0.72) CA2FABP3NFKB1GPR84MAPK1
2-Ethylhexanoic Acid SCHEMBL11336103 0.92 CA2 (0.70) CA2FABP3NFKB1GPR84MAPK1
2-Ethylhexanoic Acid SCHEMBL5486006 0.88 CA2 (0.88) CA2NFKB1MAPK1CA1
Oleic Acid SCHEMBL10522023 0.86 FABP3 (0.69) CA2FABP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6020405-A MIXTURE CONTAINING REVERSIBLY CROSSLINKED POLYMER WESTVACO CORPORATION (US) 2000-02-01 US claimed
US-6007610-A COMPRISING A REVERSIBLY-CROSSLINKED THIXOTROPIC POLYMER AND A COLORANT ON A SUBSTRATE WITH A RECORDING DEVICE OF INK-CONTACTING METAL CONSTRUCTION; MADE BY HEATING THE POLYMER AND CROSSLINKER, STIRRING, HOMOGENIZING; ADDING COLOR WESTVACO CORPORATION (US) 1999-12-28 US claimed
US-6001904-A COLORS AND REVERSE CROSSLINKED POLYMER WITH CROSSLINKING AGENTS WESTVACO CORPORATION (US) 1999-12-14 US claimed
US-5973036-A QUALITY IMAGES, SCRATCH RESISTANCE, ABRASION RESISTANCE, LOW-TEMPERATURE STORAGE STABILITY AND FLEXIBILITY, OFFSET AND PICK RESISTANCE, ADHESION, CORROSION RESISTANCE WESTVACO CORPORATION (US) 1999-10-26 US claimed