SCHEMBL14345331

SCHEMBL14345331

C#Cc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(C(=N)N3CCC(CO)CC3)cc2F)cc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.53
KCNH2 Q12809 5/20 0.44
ALOX5 P09917 1/20 0.42
ITGB3 P05106 3/20 0.39
ITGA2B P08514 3/20 0.39

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
SCHEMBL14345112 0.91 F10 (0.61) F10KCNH2ALOX5
SCHEMBL5533865 0.91 F10 (0.57) F10KCNH2
SCHEMBL5535269 0.90 F10 (0.53) F10KCNH2
SCHEMBL14345296 0.87 KCNH2 (0.61) F10KCNH2ITGB3ITGA2B
SCHEMBL14345163 0.86 F10 (0.58) F10KCNH2
SCHEMBL14345431 0.85 KCNH2 (0.59) F10KCNH2ALOX5ITGB3ITGA2B
SCHEMBL5528854 0.84 F10 (0.48) F10KCNH2ITGB3ITGA2B
SCHEMBL10178319 0.83 F10 (0.56) F10KCNH2
SCHEMBL14345441 0.83 F10 (0.44) F10KCNH2ITGB3ITGA2B
SCHEMBL14345258 0.82 F10 (0.48) F10KCNH2ITGB3ITGA2B

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