SCHEMBL17434888

SCHEMBL17434888

COc1cc(-c2ccc3ncc(C(=O)C4CC4)c(N(C)C4CCNCC4)c3c2)ccc1O

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.63

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
SCHEMBL529999 0.89 MELK (0.72) MELK
SCHEMBL529385 0.89 MELK (0.71) MELK
SCHEMBL12504770 0.88 MELK (0.59) MELK
SCHEMBL530810 0.87 MELK (0.68) MELK
SCHEMBL15190860 0.81 MELK (0.71) MELK
SCHEMBL15191021 0.80 MELK (0.77) MELK
SCHEMBL529189 0.80 MELK (0.81) MELK
SCHEMBL530953 0.78 MELK (0.74) MELK
SCHEMBL15191153 0.78 MELK (0.64) MELK
SCHEMBL15190692 0.77 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