SCHEMBL29307124

SCHEMBL29307124

CCC/C=C\CC1OC1CCCCCCCc1cccc(OCCOC)c1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 7/20 0.45
▸ PPARG P37231 4/20 0.41
▸ CNR1 P21554 1/20 0.39
▸ CNR2 P34972 1/20 0.39
▸ CYP2D6 P10635 4/20 0.38
▸ GGPS1 O95749 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ PTGIR P43119 1/20 0.36

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
SCHEMBL21623607 0.86 PPARA (0.44) PPARAPPARGCNR1CNR2ALDH1A1
SCHEMBL14520574 0.82 PPARA (0.59) PPARAPPARGCNR1CYP2D6KDM4E
SCHEMBL21623608 0.78 PPARA (0.48) PPARAPPARGCNR1CNR2ALDH1A1
SCHEMBL4568868 0.74 CYP2D6 (0.55) PPARAPPARGCNR1CNR2CYP2D6
SCHEMBL22610064 0.72 ALDH1A1 (0.51) PPARAPPARGCNR1CNR2GGPS1
SCHEMBL10235923 0.71 PPARA (0.55) PPARAPPARGCNR1CNR2CYP2D6
SCHEMBL3966708 0.71 KDM4E (0.52) PPARAPPARGCNR1CNR2CYP2D6
SCHEMBL17424577 0.71 PPARA (0.62) PPARAPPARGCNR1CNR2CYP2D6
SCHEMBL20803789 0.70 ALDH1A1 (0.48) PPARAPPARGCNR1CNR2ALDH1A1
SCHEMBL10235903 0.70 KDM4E (0.56) PPARAPPARGCNR1CNR2CYP2D6

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
WO-2024148037-A1 ELECTRODEPOSITABLE COATING COMPOSITIONS PPG INDUSTRIES OHIO, INC. (US) 2024-07-11 — — WO disclosed
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