Stearic Acid

Stearic Acid

SCHEMBL28515677

CC(C)(C)c1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1.CCCCCCCCCCCCCCCCCC(=O)O.[CaH2]

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

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 8)

geneUniProtsupporting neighboursconfidence
NR5A2 O00482 1/20 0.36
NR5A1 Q13285 1/20 0.36
GSK3B P49841 9/20 0.35
OXER1 Q8TDS5 2/20 0.35
RBP4 P02753 1/20 0.34
VCAM1 P19320 1/20 0.34
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33

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
Bumetrizole SCHEMBL8164248 0.90 NPC1 (0.40) GSK3BOXER1RBP4VCAM1
SCHEMBL28559946 0.85 SCN5A (0.36) NR5A2NR5A1GSK3BOXER1CNR1
SCHEMBL29241 0.84 NPC1 (0.41)
SCHEMBL29349567 0.84 NPC1 (0.41)
SCHEMBL8741026 0.82 CNR1 (0.38) CNR1CNR2
Propionic Acid SCHEMBL6295773 0.82 OXER1 (0.36) OXER1CNR1CNR2
SCHEMBL23908723 0.82 NPC1 (0.38) NR5A2NR5A1
SCHEMBL9879793 0.81 VCAM1 (0.36) VCAM1CNR1CNR2
SCHEMBL2187685 0.81 CYP1A2 (0.38) GSK3BCNR1CNR2
SCHEMBL28646965 0.81 VCAM1 (0.38) GSK3BVCAM1

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
CN-109721972-B PET reflective film with high reflectivity 银金达(上海)新材料有限公司 2021-01-22 CN disclosed