SCHEMBL17434896

SCHEMBL17434896

Oc1c(F)cc(-c2ccc3ncc(CC4CC4)c(Nc4cccc(CCN5CCCC5)c4)c3c2)cc1Cl

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.77

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
SCHEMBL12505177 0.89 MELK (0.75) MELK
SCHEMBL17434981 0.88 MELK (0.76) MELK
SCHEMBL17434978 0.87 MELK (0.77) MELK
SCHEMBL17434977 0.87 MELK (0.75) MELK
SCHEMBL529224 0.87 MELK (1.00) MELK
SCHEMBL17434998 0.86 MELK (0.75) MELK
Hydrochloric Acid SCHEMBL529549 0.86 MELK (0.99) MELK
SCHEMBL17434993 0.85 MELK (0.75) MELK
SCHEMBL15191217 0.85 MELK (1.00) MELK
SCHEMBL15197441 0.84 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 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