SCHEMBL530526

SCHEMBL530526

CN(C)CCc1cccc(Nc2[c]cnc3ccc(-c4cc(Cl)c(O)c(Cl)c4)cc23)c1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.66

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
SCHEMBL27925426 0.93 MELK (0.68) MELK
SCHEMBL15190804 0.85 MELK (0.66) MELK
SCHEMBL28803961 0.84 MELK (0.64) MELK
SCHEMBL15190702 0.83 MELK (0.67) MELK
SCHEMBL529252 0.83 MELK (0.68) MELK
SCHEMBL12504948 0.82 MELK (0.64) MELK
SCHEMBL15191268 0.81 MELK (0.79) MELK
SCHEMBL15191347 0.81 MELK (0.70) MELK
SCHEMBL15191165 0.81 MELK (0.69) MELK
SCHEMBL530420 0.80 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