SCHEMBL10281892

SCHEMBL10281892

CCC(=O)c1cnc2ccc(-c3cc(Cl)c(C)c(Cl)c3)cc2c1N[C@H]1CC[C@H](N(C)C)CC1

nearest known ligand 0.87

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.87

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
SCHEMBL15191655 0.93 MELK (1.00) MELK
SCHEMBL15191653 0.93 MELK (1.00) MELK
SCHEMBL10281896 0.90 MELK (1.00) MELK
SCHEMBL15191703 0.90 MELK (1.00) MELK
SCHEMBL10282339 0.90 MELK (0.87) MELK
SCHEMBL15194822 0.88 MELK (1.00) MELK
SCHEMBL15194824 0.88 MELK (1.00) MELK
SCHEMBL10282335 0.84 MELK (0.87) MELK
SCHEMBL529698 0.84 MELK (1.00) MELK
SCHEMBL529699 0.84 MELK (1.00) MELK

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
WO-2012016082-A1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2012-02-02 WO disclosed