SCHEMBL8170758

SCHEMBL8170758

CN1CCN=C1c1ccc(NC(=O)c2nnnn2-c2ccc3cc(Br)ccc3c2)c(F)c1

nearest known ligand 0.82

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.82
F2 P00734 3/20 0.44

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
SCHEMBL8165961 0.92 F10 (0.85) F10F2
SCHEMBL8159251 0.92 F10 (0.85) F10F2
SCHEMBL8171085 0.90 F10 (1.00) F10F2
SCHEMBL8170831 0.87 F10 (0.62) F10F2
SCHEMBL8163265 0.84 F10 (0.82) F10F2
SCHEMBL8170114 0.83 F10 (1.00) F10
SCHEMBL8166219 0.80 F10 (0.67) F10F2
SCHEMBL8165957 0.78 F10 (0.64) F10F2
SCHEMBL8166259 0.78 F10 (0.68) F10F2
SCHEMBL8166313 0.78 F10 (0.81) F10F2

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
US-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 US disclosed
US-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 US disclosed