SCHEMBL14397756

SCHEMBL14397756

CCCCc1ccc(OC)c(C(=O)NC(C)Cc2ccc(OC(C)(C)C(=O)O)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.45
PPARG P37231 12/20 0.45
PPARD Q03181 6/20 0.44
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL5323469 0.88 MEN1 (0.48) PPARAPPARGPPARDALDH1A1MEN1
SCHEMBL5321332 0.85 ALDH1A1 (0.59) PPARAPPARGPPARDALDH1A1MEN1
SCHEMBL14397757 0.85 ALDH1A1 (0.43) PPARAPPARGPPARDALDH1A1MEN1
SCHEMBL5326619 0.85 ALDH1A1 (0.42) PPARAPPARGPPARDALDH1A1MEN1
SCHEMBL5326505 0.84 NR1H4 (0.49) PPARAPPARGPPARDALDH1A1MEN1
SCHEMBL14397275 0.84 NR1H4 (0.49) PPARAPPARGPPARDALDH1A1MEN1
SCHEMBL5329406 0.83 PPARA (0.54) PPARAPPARGPPARDALDH1A1
SCHEMBL14398214 0.82 MEN1 (0.49) PPARAPPARGPPARDALDH1A1MEN1
SCHEMBL5328239 0.81 ACACB (0.42) PPARAPPARGPPARDALDH1A1MEN1
SCHEMBL5326276 0.79 ROCK2 (0.44) PPARAPPARGPPARDALDH1A1

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-2007118964-A1 SUBSTITUTED N-(PHENETHYL)BENZAMIDE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-10-25 WO disclosed