SCHEMBL6016859

SCHEMBL6016859

CN(CCO)C(=O)c1ccc2c(c1)nc(C(=O)O)n2Cc1cc(-c2ccc(Cl)s2)on1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.57
F2 P00734 4/20 0.41
KLK1 P06870 1/20 0.40

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
SCHEMBL1379456 0.84 F10 (0.73) F10F2KLK1
SCHEMBL6017032 0.83 F10 (0.46) F10F2KLK1
SCHEMBL6017108 0.81 F10 (0.52) F10F2
SCHEMBL3371060 0.80 F10 (0.61) F10F2KLK1
SCHEMBL1378273 0.80 F10 (0.65) F10F2KLK1
SCHEMBL3368864 0.79 F10 (0.54) F10F2
SCHEMBL6255717 0.79 F10 (0.41) F10F2KLK1
SCHEMBL6887051 0.76 F10 (0.59) F10F2KLK1
SCHEMBL3371344 0.74 F10 (0.48) F10F2KLK1
SCHEMBL1379820 0.73 F10 (0.81) F10F2KLK1

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
EP-1636216-A1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS Sanofi-Aventis Deutschland GmbH (DE) 2006-03-22 EP disclosed
WO-2004101553-A1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-11-25 WO disclosed