SCHEMBL4600448

SCHEMBL4600448

Cc1cncc(Cn2c(C(=O)O)cc3cc(F)ccc32)n1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 14/20 0.54
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
GPR35 Q9HC97 1/20 0.41
IDO1 P14902 1/20 0.41
F10 P00742 1/20 0.39
ABCB11 O95342 1/20 0.39
CCR9 P51686 1/20 0.39

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
SCHEMBL3569937 0.87 NOD2 (0.46) CCR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4599814 0.85 CCR2 (0.55) CCR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4600098 0.82 CCR2 (0.55) CCR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4599022 0.82 CCR2 (0.58) CCR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4600630 0.82 CCR2 (0.55) CCR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4599611 0.81 CCR2 (0.53) CCR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4599709 0.80 CCR2 (0.55) CCR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL15362017 0.78 ALDH1A1 (0.36) CCR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL15361967 0.78 CCR2 (0.53) CCR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL3574726 0.78 RAB9A (0.50) KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910335-B1 N-(HETEROARYL)-1-HETEROARYLALKYL-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF SANOFI SA (FR) 2013-11-06 EP claimed
EP-1910335-A1 N-(HETEROARYL)-1-HETEROARYLALKYL-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF Sanofi-Aventis (FR) 2008-04-16 EP claimed
WO-2007010144-A1 N-(HETEROARYL)-1-HETEROARYLALKYL-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF SANOFI-AVENTIS (FR) 2007-01-25 WO claimed
EP-1910335-B1 N-(HETEROARYL)-1-HETEROARYLALKYL-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF SANOFI SA (FR) 2013-11-06 EP disclosed
EP-1910335-A1 N-(HETEROARYL)-1-HETEROARYLALKYL-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF Sanofi-Aventis (FR) 2008-04-16 EP disclosed
WO-2007010144-A1 N-(HETEROARYL)-1-HETEROARYLALKYL-1H-INDOLE-2-CARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF SANOFI-AVENTIS (FR) 2007-01-25 WO disclosed