SCHEMBL3372862

SCHEMBL3372862

CCCN(C)C(=O)c1c(OCC(F)(F)F)ccc2c1nc(C(=O)NC1CCN(C(C)C)CC1)n2Cc1cc(-c2ccc(Cl)s2)on1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.59
F2 P00734 1/20 0.54
KLK1 P06870 1/20 0.54

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
SCHEMBL1377881 0.91 F10 (0.65) F10F2KLK1
SCHEMBL3367579 0.88 F10 (0.62) F10F2KLK1
SCHEMBL1381442 0.87 F10 (0.61) F10F2KLK1
SCHEMBL3371164 0.86 F10 (0.63) F10F2KLK1
SCHEMBL1381517 0.80 F10 (0.71) F10F2KLK1
SCHEMBL3373933 0.80 F10 (0.62) F10F2KLK1
SCHEMBL1380779 0.80 F10 (0.62) F10F2KLK1
SCHEMBL1379735 0.80 F10 (0.70) F10F2KLK1
SCHEMBL3370298 0.79 F10 (0.62) F10F2KLK1
SCHEMBL3374377 0.78 F10 (0.52) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636216-B1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2010-07-21 EP disclosed
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