Stearic Acid

Stearic Acid

SCHEMBL9469604

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].S=C(Nc1ccccc1)Nc1ccccc1.[Cu+2]

nearest known ligand 0.59

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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 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
SOAT2 O75908 1/20 0.53
SOAT1 P35610 1/20 0.53
EPHX1 P07099 3/20 0.51
HTT P42858 1/20 0.51
ICMT O60725 1/20 0.50
ALB P02768 1/20 0.50
GAA P10253 1/20 0.50
KMT2A Q03164 1/20 0.49
CYP3A4 P08684 1/20 0.49
TAS2R38 P59533 1/20 0.49
HSD17B10 Q99714 1/20 0.49
HDAC8 Q9BY41 4/20 0.48
HDAC3 O15379 2/20 0.48
HDAC6 Q9UBN7 2/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
HPGD P15428 1/20 0.48

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
Glutarate SCHEMBL9469147 0.88 ALDH1A1 (0.59) ALDH1A1EPHX1GAAKMT2ACYP3A4
Stearic Acid SCHEMBL9317214 0.88 CES2 (0.51) ALDH1A1SOAT2SOAT1EPHX1HTT
Stearic Acid SCHEMBL9469601 0.85 ALDH1A1 (0.56) ALDH1A1SOAT2SOAT1EPHX1HTT
Behenic Acid SCHEMBL9316970 0.85 CES2 (0.51) ALDH1A1SOAT2SOAT1EPHX1HTT
Stearic Acid SCHEMBL9317247 0.85 CES2 (0.51) ALDH1A1SOAT2SOAT1EPHX1HTT
Succinic Acid SCHEMBL9469556 0.85 ALDH1A1 (0.63) ALDH1A1EPHX1GAAKMT2ACYP3A4
Etocarlide SCHEMBL21268036 0.80 MAPT (0.62) ALDH1A1HTTGAAKMT2AHPGD
Acetic Acid SCHEMBL9470145 0.78 GAA (0.72) ALDH1A1EPHX1HTTGAAKMT2A
SCHEMBL5131381 0.77 HDAC8 (0.63) ALDH1A1SOAT2SOAT1EPHX1HTT
SCHEMBL282938 0.77 SOAT2 (0.82) ALDH1A1SOAT2SOAT1ICMTALB

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-5236633-A Blend of transparent polymer, thiourea and copper compounds JUJO PAPER CO., LTD. (JP) 1993-08-17 US disclosed