SCHEMBL4655331

SCHEMBL4655331

Cn1ccc2cc(NC(=O)c3cc4ccccc4n3-c3ccc(Cl)cc3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.51
ECE1 P42892 1/20 0.50
F10 P00742 1/20 0.50
RXFP1 Q9HBX9 1/20 0.49
NOTUM Q6P988 1/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
MAPT P10636 4/20 0.45
HTR2B P41595 3/20 0.45
TP53 P04637 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C19 P33261 2/20 0.45
RECQL P46063 2/20 0.45
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 4/20 0.44
RAB9A P51151 3/20 0.44
HTR2C P28335 4/20 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
SCHEMBL4656220 0.91 ECE1 (0.59) MAOBECE1NOTUMMEN1KMT2A
SCHEMBL3571160 0.90 ECE1 (0.48) MAOBECE1F10RXFP1NOTUM
SCHEMBL4655285 0.89 ECE1 (0.53) MAOBECE1NOTUMMEN1KMT2A
SCHEMBL4656319 0.89 ECE1 (0.50) MAOBECE1NOTUMMEN1KMT2A
SCHEMBL4655289 0.88 ECE1 (0.53) MAOBECE1NOTUMMEN1KMT2A
SCHEMBL4655301 0.88 ECE1 (0.48) MAOBECE1F10NOTUMMEN1
SCHEMBL4656120 0.87 ECE1 (0.50) MAOBECE1NOTUMMEN1KMT2A
SCHEMBL4655241 0.86 NOTUM (0.49) MAOBECE1NOTUMMEN1KMT2A
SCHEMBL4655315 0.86 ECE1 (0.48) MAOBECE1NOTUMMEN1KMT2A
SCHEMBL4655291 0.86 ECE1 (0.49) MAOBECE1NOTUMMEN1KMT2A

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