SCHEMBL17450202

SCHEMBL17450202

CCN(CC)C1CCC(Nc2c(C(=O)C3CC3)cnc3ccc(-c4ccc(O)c(OC=N)c4)cc23)CC1

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 20/20 0.84

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
SCHEMBL528882 0.91 MELK (1.00) MELK
SCHEMBL10281957 0.86 MELK (1.00) MELK
SCHEMBL15197655 0.85 MELK (0.80) MELK
SCHEMBL528910 0.83 MELK (0.83) MELK
SCHEMBL12505112 0.83 MELK (1.00) MELK
SCHEMBL530453 0.83 MELK (1.00) MELK
SCHEMBL12504916 0.83 MELK (1.00) MELK
SCHEMBL530452 0.83 MELK (1.00) MELK
SCHEMBL10281751 0.82 MELK (0.75) MELK
Hydrochloric Acid SCHEMBL12504868 0.82 MELK (0.98) 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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