SCHEMBL8166313

SCHEMBL8166313

CN(C)C(=N)c1ccc(NC(=O)c2nnnn2-c2ccc3cc(Br)ccc3c2)c(F)c1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.81
F2 P00734 1/20 0.50

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
SCHEMBL8165956 0.91 F10 (0.84) F10F2
SCHEMBL8165600 0.91 F10 (0.84) F10F2
SCHEMBL8166226 0.90 F10 (1.00) F10F2
SCHEMBL8159395 0.86 F10 (0.60) F10F2
SCHEMBL8159429 0.84 F10 (0.81) F10F2
SCHEMBL8167056 0.84 F10 (0.82) F10F2
SCHEMBL8170664 0.82 F10 (1.00) F10
SCHEMBL8165468 0.79 F10 (0.65) F10F2
SCHEMBL8170758 0.78 F10 (0.82) F10F2
SCHEMBL8158905 0.77 F10 (0.62) 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