SCHEMBL4656151

SCHEMBL4656151

Cn1ccc2cc(NC(=O)c3cc4cc(C(F)(F)F)ccc4n3Cc3cccc(F)c3)ccc21

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 13/20 0.49
ECE1 P42892 5/20 0.49
MAOB P27338 1/20 0.46
EPHX2 P34913 1/20 0.45
CCR2 P41597 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
SCHEMBL4656155 0.94 PPARG (0.56) PPARGECE1
SCHEMBL4655349 0.93 PPARG (0.54) PPARGECE1
SCHEMBL4655262 0.93 ECE1 (0.51) PPARGECE1MAOB
SCHEMBL4656134 0.91 ECE1 (0.52) PPARGECE1CCR2
SCHEMBL3579347 0.91 ECE1 (0.51) ECE1MAOBCCR2
SCHEMBL4655386 0.89 ECE1 (0.51) PPARGECE1MAOBCCR2
SCHEMBL4655266 0.89 ECE1 (0.56) ECE1MAOB
SCHEMBL4655354 0.89 KCNQ3 (0.50) PPARGECE1MAOBCCR2
SCHEMBL4655390 0.89 MAOB (0.50) PPARGECE1MAOBCCR2
SCHEMBL3574151 0.89 PPARG (0.64) PPARGECE1

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
CN-101010297-B N- (1H-indolyl) -1H-indole-2-carboxamide derivatives, their preparation and their pharmaceutical use SANOFI AVENTIS 2011-07-27 CN claimed
EP-1776340-B1 N-(1H-INDOLYL)-H-INDOLE-2-CARB0XAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI AVENTIS (FR) 2008-12-03 EP claimed