SCHEMBL530025

SCHEMBL530025

CC(C)C(=O)c1cnc2ccc(-c3cc(Cl)c(O)c(Cl)c3)cc2c1NC1CCCCC1NC(=O)O

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.70

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
SCHEMBL530480 0.94 MELK (0.72) MELK
SCHEMBL529166 0.93 MELK (0.70) MELK
SCHEMBL15190854 0.89 MELK (0.82) MELK
SCHEMBL15190855 0.89 MELK (0.82) MELK
SCHEMBL15191013 0.83 MELK (0.83) MELK
SCHEMBL15191012 0.83 MELK (0.83) MELK
SCHEMBL15197601 0.83 MELK (0.85) MELK
SCHEMBL530707 0.83 MELK (0.73) MELK
SCHEMBL529464 0.83 MELK (0.71) MELK
SCHEMBL529607 0.82 MELK (0.46) 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