SCHEMBL5379772

SCHEMBL5379772

C[C@H](C(=O)N1CCOCC1)N1CC[C@H](NS(=O)(=O)c2ccc3cc(Cl)ccc3c2)C1=O.NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.86

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
SCHEMBL4480228 0.93 F10 (1.00) F10
SCHEMBL4492830 0.93 F10 (1.00) F10
SCHEMBL6558370 0.93 F10 (1.00) F10
SCHEMBL4475660 0.93 F10 (1.00) F10
SCHEMBL6560386 0.93 F10 (1.00) F10
SCHEMBL3053557 0.93 F10 (1.00) F10
SCHEMBL5146145 0.85 F10 (1.00) F10
SCHEMBL5141867 0.85 F10 (1.00) F10
SCHEMBL5144873 0.85 F10 (0.96) F10
SCHEMBL5143258 0.85 F10 (1.00) 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
US-7226929-B2 Pyrrolidin-2-one derivatives as inhibitors of factor xa SMITHKLINE BEECHAM CORPORATION (US) 2007-06-05 US disclosed