SCHEMBL4067975

SCHEMBL4067975

C[C@@]1(c2ccccc2)C=C(c2cc(F)ccc2F)CN1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 14/20 0.55
KCNH2 Q12809 10/20 0.55

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
SCHEMBL4057860 1.00 KIF11 (0.55) KIF11KCNH2
SCHEMBL4062929 0.92 KIF11 (0.54) KIF11KCNH2
SCHEMBL4063470 0.89 KIF11 (0.67) KIF11KCNH2
SCHEMBL14273691 0.86 KIF11 (0.49) KIF11KCNH2
SCHEMBL4976803 0.86 KIF11 (0.49) KIF11KCNH2
SCHEMBL4060270 0.85 KIF11 (0.56) KIF11KCNH2
SCHEMBL4978154 0.82 KIF11 (0.52) KIF11KCNH2
SCHEMBL4061574 0.80 KCNH2 (0.46) KIF11KCNH2
SCHEMBL14262918 0.80 KIF11 (0.45) KIF11KCNH2
SCHEMBL5181841 0.79 KIF11 (0.70) 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 4 patents. 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
EP-1515724-A4 MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2005-08-17 EP disclosed
EP-1515724-A1 MITOTIC KINESIN INHIBITORS Merck & Co., Inc. (US) 2005-03-23 EP disclosed
WO-2003105855-A1 MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2003-12-24 WO disclosed