SCHEMBL528994

SCHEMBL528994

CC(=O)Cc1cnc2ccc(-c3cc(F)c(O)c(Cl)c3)cc2c1NC1CCC(CN(C)C)CC1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.80

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
SCHEMBL529462 0.95 MELK (0.79) MELK
Hydrochloric Acid SCHEMBL529599 0.94 MELK (0.77) MELK
SCHEMBL17434846 0.92 MELK (0.79) MELK
SCHEMBL528533 0.90 MELK (0.78) MELK
SCHEMBL15191044 0.89 MELK (1.00) MELK
SCHEMBL10281976 0.89 MELK (1.00) MELK
Hydrochloric Acid SCHEMBL15190731 0.88 MELK (0.98) MELK
Hydrochloric Acid SCHEMBL15190732 0.88 MELK (0.98) MELK
SCHEMBL17434958 0.87 MELK (0.80) MELK
SCHEMBL15194789 0.87 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