SCHEMBL3370292

SCHEMBL3370292

COCCOc1cccc2c1nc(OC(=O)Nc1ccc(N3CCOCC3=O)cc1)n2CC(=O)Nc1ccc(Cl)cn1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.49
MTOR P42345 3/20 0.39
PTGS2 P35354 1/20 0.37

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
SCHEMBL1380369 0.90 F10 (0.52) F10MTOR
SCHEMBL3372955 0.85 F10 (0.50) F10PTGS2
SCHEMBL3374375 0.84 F10 (0.52) F10MTORPTGS2
SCHEMBL3372855 0.82 F10 (0.50) F10MTORPTGS2
SCHEMBL3371019 0.80 F10 (0.55) F10MTOR
SCHEMBL3371107 0.77 F10 (0.52) F10PTGS2
SCHEMBL3371678 0.76 F10 (0.61) F10
SCHEMBL1378964 0.76 F10 (0.66) F10PTGS2
SCHEMBL4417487 0.76 F10 (0.49) F10PTGS2
SCHEMBL3371388 0.75 F10 (0.51) F10

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