SCHEMBL17435017

SCHEMBL17435017

CN1CCN(c2ccc(Nc3c(CC4CC4)cnc4ccc(-c5cc(Cl)c(O)c(Cl)c5)cc34)cn2)CC1

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
SCHEMBL17434899 0.90 MELK (0.73) MELK
SCHEMBL529152 0.90 MELK (0.73) MELK
SCHEMBL17434933 0.88 MELK (0.74) MELK
SCHEMBL17434883 0.87 MELK (0.74) MELK
SCHEMBL17434918 0.86 MELK (0.75) MELK
SCHEMBL530560 0.85 MELK (1.00) MELK
SCHEMBL530742 0.83 MELK (1.00) MELK
SCHEMBL17434834 0.81 MELK (0.73) MELK
SCHEMBL15190709 0.80 MELK (1.00) MELK
SCHEMBL17434887 0.80 MELK (0.74) 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