SCHEMBL17434946

SCHEMBL17434946

COc1cc(-c2ccc3ncc(CC4CC4)c(Nc4ccc(OCCN)nc4)c3c2)cc(Cl)c1O

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 20/20 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
SCHEMBL12504784 0.87 MELK (1.00) MELK
SCHEMBL17434913 0.84 MELK (0.74) MELK
SCHEMBL15191035 0.80 MELK (0.65) MELK
SCHEMBL17435003 0.80 MELK (0.75) MELK
SCHEMBL17434864 0.79 MELK (0.77) MELK
SCHEMBL529477 0.79 MELK (1.00) MELK
SCHEMBL12504793 0.78 MELK (1.00) MELK
SCHEMBL17434829 0.78 MELK (0.72) MELK
SCHEMBL17434889 0.77 MELK (0.78) MELK
SCHEMBL531725 0.76 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
EP-2597955-B1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE INC (JP) 2016-01-20 — — EP disclosed
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