SCHEMBL17450171

SCHEMBL17450171

Nc1cc(-c2ccc3ncc(C(=O)C4CC4)c(N4CCC(CN5CCCC5)CC4)c3c2)cc(F)c1O

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.83

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
SCHEMBL528952 0.91 MELK (1.00) MELK
SCHEMBL15197662 0.90 MELK (0.81) MELK
SCHEMBL529264 0.89 MELK (1.00) MELK
SCHEMBL15191065 0.84 MELK (0.87) MELK
SCHEMBL531190 0.83 MELK (0.89) MELK
SCHEMBL15197663 0.83 MELK (0.74) MELK
SCHEMBL529585 0.83 MELK (0.86) MELK
SCHEMBL15197661 0.82 MELK (0.81) MELK
SCHEMBL10282296 0.82 MELK (1.00) MELK
SCHEMBL10281968 0.81 MELK (0.86) 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