SCHEMBL4550502

SCHEMBL4550502

CNS(=O)(=O)c1cc(-n2ccccc2=O)ccc1-n1cnc(CNC(=O)c2ccc(Cl)s2)c1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.49
F2 P00734 1/20 0.43
F11 P03951 1/20 0.43
HPGD P15428 1/20 0.41

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
SCHEMBL1277393 0.92 F10 (0.51) F10F2F11HPGD
SCHEMBL1277293 0.86 F10 (0.54) F10HPGD
SCHEMBL1277483 0.85 F10 (0.59) F10
SCHEMBL1277428 0.85 F10 (0.51) F10F2F11HPGD
SCHEMBL1277491 0.85 F10 (0.51) F10
SCHEMBL1277720 0.84 F10 (0.49) F10
SCHEMBL8232231 0.84 F10 (0.52) F10F2HPGD
SCHEMBL1277302 0.83 F10 (0.49) F10HPGD
SCHEMBL1277421 0.83 F10 (0.49) F10
SCHEMBL1277601 0.83 F10 (0.63) F10F2F11HPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2016072-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-01-21 EP disclosed
WO-2007131179-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-11-15 WO disclosed