SCHEMBL14366388

SCHEMBL14366388

Cc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(C#N)cc2)nc1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.71
KCNH2 Q12809 1/20 0.60
KLKB1 P03952 3/20 0.59
TMPRSS4 Q9NRS4 1/20 0.59

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
SCHEMBL799832 0.92 F10 (0.72) F10KCNH2KLKB1
SCHEMBL890676 0.92 F10 (0.74) F10KCNH2KLKB1
SCHEMBL890820 0.88 F10 (0.64) F10KCNH2KLKB1TMPRSS4
SCHEMBL5383293 0.86 F10 (0.74) F10KCNH2KLKB1
SCHEMBL805112 0.86 RAB9A (0.58) F10KCNH2
SCHEMBL890632 0.85 F10 (0.71) F10KCNH2KLKB1TMPRSS4
SCHEMBL14366447 0.85 F10 (0.61) F10KCNH2KLKB1TMPRSS4
SCHEMBL4854339 0.84 F10 (0.71) F10KCNH2KLKB1
SCHEMBL6713951 0.84 F10 (0.69) F10KCNH2KLKB1
SCHEMBL254113 0.83 F10 (0.72) F10KCNH2KLKB1

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-7312235-B2 Benzamide inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-12-25 US disclosed