SCHEMBL1029382

SCHEMBL1029382

CCS(=O)(=O)N(C)C1CC(C(=O)Nc2ccc(Cl)cc2)C(C(=O)Nc2ccc(-n3ccccc3=O)cc2F)C1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.73

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
SCHEMBL13678816 1.00 F10 (0.73) F10
SCHEMBL13678815 0.93 F10 (0.75) F10
SCHEMBL1029268 0.93 F10 (0.75) F10
SCHEMBL13678814 0.93 F10 (0.75) F10
SCHEMBL13678817 0.91 F10 (0.74) F10
SCHEMBL13678811 0.89 F10 (0.74) F10
SCHEMBL1029519 0.89 F10 (0.74) F10
SCHEMBL1029757 0.89 F10 (0.72) F10
SCHEMBL13678812 0.89 F10 (0.72) F10
SCHEMBL1030154 0.86 F10 (0.84) 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
EP-1814855-B1 DICARBOXAMIDE DERIVATIVES AND THEIR USE AS FACTOR XA INHIBITORS HOFFMANN LA ROCHE (CH) 2011-01-19 EP disclosed