SCHEMBL6435704

SCHEMBL6435704

COc1cccc2c1cc(C(=O)O)n2Cc1cccc(C(=N)N)c1

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.73
CCR2 P41597 1/20 0.66
F2 P00734 1/20 0.57

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
SCHEMBL6439390 0.84 F10 (0.85) F10F2
Acetic Acid SCHEMBL6436692 0.84 F10 (0.95) F10F2
SCHEMBL3963296 0.83 CCR2 (0.72) F10CCR2
Hydrochloric Acid SCHEMBL6434381 0.82 F10 (0.98) F10F2
SCHEMBL6432819 0.80 F10 (0.84) F10CCR2F2
SCHEMBL6433546 0.80 CCR2 (0.67) F10CCR2
SCHEMBL6308101 0.79 CCR2 (1.00) CCR2
SCHEMBL699964 0.76 CCR2 (0.65) CCR2
Trifluoroacetic Acid SCHEMBL6435718 0.76 F10 (0.75) F10F2
Trifluoroacetic Acid SCHEMBL6436035 0.76 F10 (0.96) F10F2

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