SCHEMBL4656134

SCHEMBL4656134

Cn1ccc2cc(NC(=O)c3cc4cc(C(F)(F)F)ccc4n3Cc3ccccc3)ccc21

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 9/20 0.52
PPARG P37231 9/20 0.51
CCR2 P41597 1/20 0.49
KCNQ3 O43525 1/20 0.46
KCNQ2 O43526 1/20 0.46
KCNQ4 P56696 1/20 0.46
KCNQ5 Q9NR82 1/20 0.46

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) ECE1PPARG
SCHEMBL4656151 0.91 PPARG (0.49) ECE1PPARGCCR2
SCHEMBL3574151 0.90 PPARG (0.64) ECE1PPARG
SCHEMBL4655334 0.89 PPARG (0.61) ECE1PPARG
SCHEMBL4655354 0.88 KCNQ3 (0.50) ECE1PPARGCCR2KCNQ3KCNQ2
SCHEMBL4657644 0.88 ECE1 (0.52) ECE1CCR2
SCHEMBL4655243 0.88 PPARG (0.56) ECE1PPARG
SCHEMBL4655349 0.88 PPARG (0.54) ECE1PPARG
SCHEMBL3578189 0.85 PPARG (0.55) ECE1PPARGCCR2
SCHEMBL4655262 0.84 ECE1 (0.51) ECE1PPARG

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