SCHEMBL1029273

SCHEMBL1029273

O=C(Nc1ccc(Cl)cc1)C1CC(O)(CO)CC1C(=O)Nc1ccc(-n2ccccc2=O)cc1F

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
SCHEMBL12955865 1.00 F10 (0.73) F10
SCHEMBL1030048 0.91 F10 (0.72) F10
SCHEMBL13678823 0.91 F10 (0.72) F10
SCHEMBL1030523 0.90 F10 (0.69) F10
SCHEMBL8260232 0.90 F10 (0.69) F10
SCHEMBL13678828 0.89 F10 (0.75) F10
SCHEMBL1028708 0.89 F10 (0.75) F10
SCHEMBL1030621 0.89 F10 (0.78) F10
SCHEMBL8262068 0.88 F10 (0.77) F10
SCHEMBL1031263 0.88 F10 (0.72) 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