SCHEMBL5534264

SCHEMBL5534264

C#Cc1ccc(NC(=O)c2cc(Cl)cc(OC)c2NC(=O)c2ccc(N=CN3CCC(OC(=O)O)CC3)c(F)c2)nc1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.47
F10 P00742 17/20 0.44
F2 P00734 7/20 0.40

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
SCHEMBL5534858 0.93 KCNH2 (0.50) KCNH2F10F2
SCHEMBL5534467 0.90 F10 (0.48) KCNH2F10F2
SCHEMBL5531291 0.89 KCNH2 (0.61) KCNH2F10F2
SCHEMBL5532858 0.83 F10 (0.49) KCNH2F10F2
SCHEMBL5531282 0.81 F10 (0.49) KCNH2F10F2
SCHEMBL5539613 0.80 F10 (0.40) KCNH2F10F2
SCHEMBL5534090 0.79 KCNH2 (0.58) KCNH2F10F2
SCHEMBL5536595 0.79 KCNH2 (0.39) KCNH2F10F2
SCHEMBL14345251 0.76 KCNH2 (0.72) KCNH2F10F2
SCHEMBL5532846 0.75 F10 (0.49) KCNH2F10F2

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
EP-1373194-B1 BENZAMIDE INHIBITORS OF FACTOR Xa MILLENNIUM PHARM INC (US) 2007-08-01 EP claimed