SCHEMBL528533

SCHEMBL528533

CC(=O)Cc1cnc2ccc(-c3cc(F)c(O)c(Cl)c3)cc2c1NC1CCC(N(C)C)CC1

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.78

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
SCHEMBL528994 0.90 MELK (0.80) MELK
SCHEMBL12504853 0.88 MELK (0.71) MELK
SCHEMBL15191516 0.87 MELK (1.00) MELK
SCHEMBL529697 0.87 MELK (1.00) MELK
SCHEMBL15190802 0.85 MELK (0.83) MELK
SCHEMBL15190803 0.85 MELK (0.83) MELK
SCHEMBL10281896 0.85 MELK (1.00) MELK
SCHEMBL15191703 0.85 MELK (1.00) MELK
SCHEMBL529462 0.85 MELK (0.79) MELK
SCHEMBL10282430 0.85 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2597955-A1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME OncoTherapy Science, Inc. (JP) 2013-06-05 EP disclosed
WO-2012016082-A1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2012-02-02 WO disclosed