SCHEMBL1029787

SCHEMBL1029787

O=C(Nc1ccc(Cl)cc1)C1CC2(CO2)CC1C(=O)Nc1ccc(-n2ccccc2=O)cc1F

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.77

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
SCHEMBL13678804 1.00 F10 (0.77) F10
SCHEMBL1029716 0.93 F10 (0.71) F10
SCHEMBL13678827 0.93 F10 (0.71) F10
SCHEMBL1030621 0.91 F10 (0.78) F10
SCHEMBL8262068 0.90 F10 (0.77) F10
SCHEMBL1028708 0.89 F10 (0.75) F10
SCHEMBL13678828 0.89 F10 (0.75) F10
SCHEMBL8261774 0.89 F10 (0.84) F10
SCHEMBL1030154 0.89 F10 (0.84) F10
SCHEMBL12955865 0.88 F10 (0.73) 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-1814855-B1 DICARBOXAMIDE DERIVATIVES AND THEIR USE AS FACTOR XA INHIBITORS HOFFMANN LA ROCHE (CH) 2011-01-19 EP disclosed
EP-1814855-A2 DICARBOXAMIDE DERIVATIVES AND THEIR USE AS FACTOR XA INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2007-08-08 EP disclosed
WO-2006048152-A2 DICARBOXAMIDE DERIVATIVES AND THEIR USE AS FACTOR XA INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2006-05-11 WO disclosed