SCHEMBL529381

SCHEMBL529381

CN(C)C(O)Cc1ccc(Nc2c(C(=O)C3CC3)cnc3ccc(-c4cc(Cl)c(O)c(Cl)c4)cc23)cc1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 20/20 0.79

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
SCHEMBL529632 0.95 MELK (0.78) MELK
SCHEMBL529194 0.88 MELK (1.00) MELK
SCHEMBL530154 0.87 MELK (1.00) MELK
Hydrochloric Acid SCHEMBL15190830 0.86 MELK (0.98) MELK
SCHEMBL529380 0.86 MELK (1.00) MELK
Hydrochloric Acid SCHEMBL528971 0.86 MELK (0.98) MELK
SCHEMBL528763 0.86 MELK (1.00) MELK
Hydrochloric Acid SCHEMBL530532 0.85 MELK (0.98) MELK
SCHEMBL10282223 0.84 MELK (0.94) MELK
SCHEMBL15191125 0.83 MELK (0.79) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2597955-A1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME OncoTherapy Science, Inc. (JP) 2013-06-05 — — EP disclosed
WO-2012016082-A1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2012-02-02 — — WO disclosed
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