SCHEMBL3371000

SCHEMBL3371000

Cc1cc(F)c(C(=O)N(C)CCO)c2nc(C(=O)NC3CCN(C(C)C)CC3)n(Cc3nnc(-c4ccc(Cl)s4)s3)c12

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.55
F2 P00734 1/20 0.40
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
SCHEMBL3405029 0.88 F10 (0.60) F10F2KLK1
SCHEMBL3369659 0.72 F10 (0.49) F10F2
SCHEMBL1675534 0.72 F10 (1.00) F10F2KLK1
SCHEMBL1379735 0.71 F10 (0.70) F10F2KLK1
SCHEMBL3401010 0.71 F10 (0.38) F10
SCHEMBL3368841 0.70 F10 (0.48) F10F2
SCHEMBL3398371 0.70 F10 (0.57) F10F2
SCHEMBL1675029 0.70 F10 (0.81) F10F2KLK1
SCHEMBL1379456 0.69 F10 (0.73) F10F2KLK1
SCHEMBL15911459 0.69 F10 (0.80) 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