SCHEMBL1455896

SCHEMBL1455896

CC(C)N1CCC(NC(=O)c2cc(OCC(F)(F)F)nn2CC(=O)Nc2ccc(Cl)cn2)CC1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.61
F2 P00734 2/20 0.61

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
SCHEMBL1456399 0.94 F10 (0.61) F10F2
SCHEMBL1456445 0.94 F10 (0.59) F10F2
SCHEMBL1456883 0.92 F10 (0.57) F10F2
SCHEMBL1455973 0.90 F10 (0.59) F10F2
SCHEMBL1456452 0.90 F10 (0.62) F10F2
SCHEMBL1456810 0.90 F10 (0.62) F10F2
SCHEMBL1455671 0.87 F10 (0.70) F10F2
SCHEMBL1456302 0.87 F10 (0.59) F10F2
SCHEMBL1455894 0.86 F10 (0.57) F10F2
SCHEMBL1455917 0.85 F10 (0.64) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7910606-B2 Pyrazole-derivatives as factor Xa inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-03-22 US claimed
US-7910606-B2 Pyrazole-derivatives as factor Xa inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-03-22 US disclosed