SCHEMBL6432403

SCHEMBL6432403

N#Cc1cccc(Cn2c(C(=O)NCCc3ccncc3)cc3ccccc32)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.50
ROCK2 O75116 1/20 0.50
F10 P00742 7/20 0.48
CNR1 P21554 7/20 0.48
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
NPY5R Q15761 1/20 0.43

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
SCHEMBL6432441 0.90 F10 (0.58) CCR2ROCK2F10CNR1
SCHEMBL6436677 0.84 F10 (0.59) CCR2ROCK2F10CNR1NPY5R
SCHEMBL6436698 0.83 F10 (0.66) CCR2F10CNR1
SCHEMBL6434131 0.82 F10 (0.59) F10
SCHEMBL6432886 0.81 F10 (0.56) CCR2F10CNR1
SCHEMBL6433060 0.81 F10 (0.71) CCR2F10CNR1
SCHEMBL6432496 0.81 F10 (0.62) CCR2F10CNR1
SCHEMBL7712483 0.81 F10 (0.53) CCR2F10CNR1
SCHEMBL6434800 0.80 CCR2 (0.53) CCR2F10CNR1
SCHEMBL6436901 0.79 F10 (0.69) CCR2F10CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042287-B1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA AVENTIS PHARMA GMBH (DE) 2005-04-20 EP disclosed
US-6337344-B1 ANTICOAGULANTS AND ENZYME INHIBITORS FOR CARDIOVASCULAR DISORDERS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-01-08 US disclosed
EP-1042287-A1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA Aventis Pharma Deutschland GmbH (DE) 2000-10-11 EP disclosed
WO-1999033800-A1 INDOLE DERIVATIVES AS INHIBITORS OR FACTOR XA AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-08 WO disclosed