SCHEMBL17434945

SCHEMBL17434945

CCc1cnc2ccc(-c3cc(Cl)c(O)c(Cl)c3)cc2c1Nc1ccc(N2CCC(N(C)C)C2)nc1

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.81

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
SCHEMBL12504828 0.94 MELK (0.75) MELK
SCHEMBL530069 0.94 MELK (0.77) MELK
Hydrochloric Acid SCHEMBL529055 0.93 MELK (0.74) MELK
SCHEMBL12504812 0.91 MELK (0.76) MELK
SCHEMBL12505072 0.90 MELK (0.78) MELK
SCHEMBL15191663 0.90 MELK (1.00) MELK
SCHEMBL15197490 0.89 MELK (1.00) MELK
SCHEMBL15191303 0.89 MELK (1.00) MELK
Hydrochloric Acid SCHEMBL529054 0.88 MELK (0.98) MELK
SCHEMBL15190653 0.88 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