SCHEMBL5768142

SCHEMBL5768142

CNCc1nccn1-c1ccc(N2CCCC([N]S(=O)(=O)c3cc4ccc(Cl)nc4s3)C2=O)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 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
SCHEMBL5768149 0.87 F10 (0.75) F10
SCHEMBL4481886 0.81 F10 (0.70) F10
SCHEMBL6711412 0.79 F10 (0.74) F10
SCHEMBL4470517 0.74 F10 (0.64) F10
SCHEMBL4468831 0.74 F10 (0.49) F10
SCHEMBL4471528 0.74 F10 (0.49) F10
SCHEMBL4467797 0.74 F10 (0.64) F10
SCHEMBL4479220 0.72 F10 (1.00) F10
SCHEMBL4471526 0.71 F10 (0.47) F10
SCHEMBL4475936 0.70 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501798-A4 SULFONYLAMINOVALEROLAC TAMS AND DERIVATIVES THEREOF AS FACTOR Xa INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2006-11-22 EP disclosed
EP-1501798-A2 SULFONYLAMINOVALEROLAC TAMS AND DERIVATIVES THEREOF AS FACTOR Xa INHIBITORS Bristol-Myers Squibb Company (US) 2005-02-02 EP disclosed
WO-2004041776-A2 SULFONYLAMINOVALEROLAC TAMS AND DERIVATIVES THEREOF AS FACTOR Xa INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-05-21 WO disclosed