SCHEMBL8170302

SCHEMBL8170302

CC(C)NC(=O)CNc1cc(-n2ccccc2=O)ccc1-n1cc(CNC(=O)c2ccc(Cl)s2)nn1

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.49

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
SCHEMBL8152039 0.92 F10 (0.48) F10
SCHEMBL8152042 0.91 F10 (0.48) F10
SCHEMBL8151772 0.89 F10 (0.49) F10
SCHEMBL1751397 0.87 F10 (0.52) F10
SCHEMBL1751336 0.87 F10 (0.52) F10
SCHEMBL1752107 0.86 F10 (0.51) F10
SCHEMBL1752003 0.86 F10 (0.49) F10
SCHEMBL1751680 0.86 F10 (0.51) F10
SCHEMBL1752637 0.85 F10 (0.49) F10
SCHEMBL1752321 0.85 F10 (0.49) 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
WO-2008086226-A2 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-07-17 WO disclosed