SCHEMBL530707

SCHEMBL530707

O=C(O)NC1CCCCC1Nc1c(C(=O)C2CC2)cnc2ccc(-c3cc(F)c(O)c(Cl)c3)cc12

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.73

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
SCHEMBL530617 0.93 MELK (0.67) MELK
SCHEMBL530480 0.89 MELK (0.72) MELK
SCHEMBL15191192 0.89 MELK (0.82) MELK
SCHEMBL15191189 0.89 MELK (0.82) MELK
SCHEMBL529137 0.85 MELK (0.68) MELK
SCHEMBL529710 0.85 MELK (0.66) MELK
SCHEMBL528699 0.84 MELK (1.00) MELK
SCHEMBL15191793 0.83 MELK (1.00) MELK
SCHEMBL15197333 0.83 MELK (1.00) MELK
SCHEMBL15191266 0.83 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 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