SCHEMBL5353768

SCHEMBL5353768

CC(Cc1ccc(OC(C)(C)C(=O)O)cc1)NC(=O)c1cc(C(F)(F)F)ccc1N1C[C@H](C)C[C@H](C)C1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 9/20 0.43
PPARD Q03181 7/20 0.43
LIPG Q9Y5X9 8/20 0.41
ACACB O00763 2/20 0.40
CNR1 P21554 1/20 0.40
PPARG P37231 3/20 0.39
LIPC P11150 3/20 0.38
LPL P06858 2/20 0.37

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
SCHEMBL14399164 0.91 PPARD (0.43) PPARAPPARDLIPGACACBCNR1
SCHEMBL5324085 0.88 PPARA (0.48) PPARAPPARDACACBCNR1PPARG
SCHEMBL14399420 0.87 PPARA (0.47) PPARAPPARDCNR1PPARG
SCHEMBL5325989 0.87 PPARA (0.47) PPARAPPARDCNR1PPARG
SCHEMBL5353765 0.87 PPARA (0.44) PPARAPPARDACACBCNR1PPARG
SCHEMBL5329725 0.86 TPH1 (0.40) PPARAPPARDACACBCNR1PPARG
SCHEMBL5325952 0.85 PPARA (0.51) PPARAPPARDCNR1PPARG
SCHEMBL5326681 0.81 CNR1 (0.48) PPARAPPARDACACBCNR1PPARG
SCHEMBL5330018 0.81 PPARA (0.47) PPARAPPARDCNR1PPARG
SCHEMBL5329478 0.80 PPARA (0.54) PPARAPPARDCNR1PPARG

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-2007118963-A2 SUBSTITUTED N-(PHENETHYL)BENZAMIDE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-10-25 WO disclosed