SCHEMBL4746929

SCHEMBL4746929

CN(C)C(=O)N1CC(NC(=O)c2ccc(-n3ccccc3=O)cc2)[CH]C1C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.52
F2 P00734 1/20 0.44
F11 P03951 1/20 0.44

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
SCHEMBL4744597 0.90 F10 (0.49) F10
SCHEMBL4748457 0.89 F10 (0.50) F10F2F11
SCHEMBL4854342 0.88 F10 (0.52) F10F2F11
SCHEMBL5432186 0.86 F10 (0.52) F10F2F11
SCHEMBL4744634 0.86 F10 (0.53) F10F2F11
SCHEMBL5429197 0.86 F10 (0.51) F10F2
SCHEMBL5434815 0.85 F10 (0.52) F10F2F11
SCHEMBL5447274 0.85 F10 (0.52) F10F2
SCHEMBL4807937 0.83 F10 (0.54) F10F2F11
SCHEMBL5437919 0.83 F10 (0.54) F10F2

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-1603572-A4 LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2008-06-25 EP disclosed
EP-1603572-A1 LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS Bristol-Myers Squibb Company (US) 2005-12-14 EP disclosed
WO-2004082687-A1 LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-09-30 WO disclosed