SCHEMBL3369769

SCHEMBL3369769

CC(C)N1CCC(NC(=O)Oc2nc3cc(C(=O)N4CC(O)C4)ccc3n2Cc2cc(-c3ccc(Cl)s3)on2)CC1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.59
F2 P00734 2/20 0.56
KLK1 P06870 1/20 0.56

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
SCHEMBL3238972 0.89 F10 (0.63) F10F2KLK1
SCHEMBL1382012 0.89 F10 (0.75) F10F2KLK1
SCHEMBL3369756 0.87 F10 (0.59) F10F2KLK1
SCHEMBL3372764 0.86 F10 (0.77) F10F2KLK1
SCHEMBL4411770 0.85 F10 (0.62) F10F2KLK1
SCHEMBL1654301 0.84 F10 (0.78) F10F2KLK1
SCHEMBL4606755 0.83 F10 (0.58) F10F2KLK1
SCHEMBL3371482 0.83 F10 (0.61) F10F2KLK1
SCHEMBL3374377 0.83 F10 (0.52) F10F2KLK1
SCHEMBL6016943 0.82 F10 (0.57) 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 1 patent. 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 claimed