SCHEMBL4599865

SCHEMBL4599865

O=C(O)c1cc2cc(F)ccc2n1Cc1nccn1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 11/20 0.55
GPR35 Q9HC97 1/20 0.48
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PTGS1 P23219 2/20 0.43
PTGS2 P35354 2/20 0.43
HSP90AA1 P07900 1/20 0.43
PLA2G4A P47712 1/20 0.43
RAB9A P51151 1/20 0.43
SERPINE1 P05121 1/20 0.42

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
SCHEMBL3618715 0.87 NOD2 (0.50) CCR2KDM4EALDH1A1HPGDHSP90AA1
SCHEMBL15361980 0.80 OPRD1 (0.44) HSP90AA1RAB9A
SCHEMBL2895007 0.78 CCR2 (0.70) CCR2GPR35KDM4EALDH1A1HPGD
SCHEMBL4600229 0.78 CCR2 (0.56) CCR2GPR35KDM4EALDH1A1HPGD
SCHEMBL832189 0.77 CCR2 (0.71) CCR2GPR35KDM4EALDH1A1HPGD
SCHEMBL4600132 0.77 CCR2 (0.61) CCR2GPR35KDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL926656 0.76 CCR2 (0.70) CCR2GPR35KDM4EALDH1A1HPGD
SCHEMBL4599842 0.75 CCR2 (0.59) CCR2GPR35KDM4EALDH1A1HPGD
SCHEMBL6308068 0.75 CCR2 (0.73) CCR2GPR35PTGS1PTGS2
SCHEMBL7239402 0.75 CCR2 (0.69) CCR2GPR35PTGS1PTGS2SERPINE1

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 3 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