SCHEMBL8170491

SCHEMBL8170491

COc1ccc(-n2nc(C)cc2C(=O)Nc2ccc(C(=N)N(C)C)cc2)c(S(N)(=O)=O)c1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 20/20 0.60

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
SCHEMBL8159555 0.92 F10 (0.61) F10
SCHEMBL8164435 0.88 F10 (0.68) F10
SCHEMBL8165214 0.86 F10 (0.75) F10
SCHEMBL8405134 0.86 F10 (0.64) F10
SCHEMBL8166644 0.86 KCNH2 (0.57) F10
SCHEMBL8171351 0.86 KCNH2 (0.59) F10
SCHEMBL8159704 0.85 KCNH2 (0.58) F10
SCHEMBL8167270 0.81 F10 (0.51) F10
SCHEMBL8166040 0.81 F10 (0.53) F10
SCHEMBL8159660 0.81 F10 (0.79) 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
US-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 — — US disclosed
Send feedback