SCHEMBL17434864

SCHEMBL17434864

COc1cc(-c2ccc3ncc(CC4CC4)c(Nc4ccc(CN5CCOCC5)cc4)c3c2)cc(Cl)c1O

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.77

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
SCHEMBL17434873 0.92 MELK (0.74) MELK
SCHEMBL17434889 0.87 MELK (0.78) MELK
SCHEMBL12504857 0.87 MELK (1.00) MELK
SCHEMBL17434941 0.85 MELK (0.80) MELK
SCHEMBL17434913 0.83 MELK (0.74) MELK
SCHEMBL17434839 0.82 MELK (0.75) MELK
SCHEMBL15191270 0.82 MELK (0.68) MELK
SCHEMBL17434977 0.82 MELK (0.75) MELK
SCHEMBL17435003 0.81 MELK (0.75) MELK
SCHEMBL15191636 0.81 MELK (0.66) 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