SCHEMBL13655863

SCHEMBL13655863

CBc1cccc(C2C=C(c3cc(F)ccc3F)CN2C(=O)N(C)C)c1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.77
KCNH2 Q12809 14/20 0.76

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
SCHEMBL4069041 0.90 KIF11 (0.87) KIF11KCNH2
SCHEMBL4058145 0.87 KIF11 (1.00) KIF11KCNH2
SCHEMBL4029381 0.87 KIF11 (1.00) KIF11KCNH2
SCHEMBL4057497 0.87 KIF11 (1.00) KIF11KCNH2
SCHEMBL4070085 0.87 KIF11 (0.82) KIF11KCNH2
SCHEMBL4063819 0.87 KIF11 (1.00) KIF11KCNH2
SCHEMBL4058293 0.86 KIF11 (0.80) KIF11KCNH2
SCHEMBL4057812 0.86 KIF11 (0.80) KIF11KCNH2
SCHEMBL4057947 0.85 KIF11 (0.87) KIF11KCNH2
SCHEMBL4689754 0.82 KIF11 (0.73) KIF11KCNH2

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-1515724-B1 MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2009-10-21 EP disclosed