Stearic Acid

Stearic Acid

SCHEMBL10430552

CCCCCCCCCCCCCCCCCC(=O)O.Cc1cccc(NCc2ccccc2)c1C

nearest known ligand 0.52

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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
EPHX2 P34913 3/20 0.52
PLK1 P53350 2/20 0.51
P2RX7 Q99572 1/20 0.49
POLB P06746 1/20 0.49
FAAH O00519 2/20 0.46
MAPT P10636 2/20 0.46
TP53 P04637 1/20 0.46
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
S1PR1 P21453 2/20 0.45
S1PR3 Q99500 2/20 0.45
S1PR2 O95136 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
HDAC11 Q96DB2 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC3 O15379 1/20 0.44

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
Butyric Acid SCHEMBL29049202 0.90 POLB (0.53) POLBMAPTTP53GAAMAPK1
Propionic Acid SCHEMBL29049218 0.85 HSD17B10 (0.54) POLBMAPTTP53GAAMAPK1
Malonic Acid SCHEMBL29049213 0.84 HSD17B10 (0.55) POLBMAPTTP53GAAMAPK1
Bicarbonate SCHEMBL29049243 0.84 HSD17B10 (0.58) POLBMAPTTP53GAAMAPK1
Oxalic Acid SCHEMBL29049203 0.82 HSD17B10 (0.56) POLBMAPTTP53GAAMAPK1
Acetic Acid SCHEMBL29049224 0.82 HSD17B10 (0.56) POLBMAPTTP53GAAMAPK1
Chloroacetic Acid SCHEMBL29049239 0.81 HSD17B10 (0.52) POLBMAPTTP53GAAMAPK1
Hydrochloric Acid SCHEMBL4373569 0.79 HSD17B10 (0.58) POLBMAPTTP53GAAMAPK1
Bromide SCHEMBL29049211 0.79 HSD17B10 (0.58) POLBMAPTTP53GAAMAPK1
Iodide SCHEMBL29049215 0.79 HSD17B10 (0.58) POLBMAPTTP53GAAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0362459-A1 Polyacrylate polymers utilizing substituted urea retarder Zeon Chemicals USA, Inc. (US) 1990-04-11 EP disclosed
EP-0309794-A2 No-post-cure method of curing polyacrylate polymers Zeon Chemicals USA, Inc. (US) 1989-04-05 EP disclosed