SCHEMBL27907356

SCHEMBL27907356

CCC(=O)c1cnc2ccc(-c3cc(Cl)c(O)c(OC)c3)cc2c1N1CCC(CN(C)C)CC1

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MELK Q14680 20/20 0.86

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
SCHEMBL10282374 0.92 MELK (1.00) MELK
SCHEMBL530552 0.92 MELK (1.00) MELK
SCHEMBL15190771 0.92 MELK (0.82) MELK
SCHEMBL528902 0.90 MELK (0.84) MELK
SCHEMBL15191561 0.90 MELK (0.84) MELK
SCHEMBL15191057 0.89 MELK (0.94) MELK
SCHEMBL28804065 0.89 MELK (0.86) MELK
SCHEMBL27907365 0.88 MELK (0.84) MELK
SCHEMBL530994 0.87 MELK (1.00) MELK
SCHEMBL10281821 0.85 MELK (0.86) 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
CN-103153063-A Quinoline derivatives and MELK inhibitors containing the same ONCOTHERAPY SCIENCE INC 2013-06-12 CN disclosed