SCHEMBL16159191

SCHEMBL16159191

C1=COC(c2cccc(-c3c4ccccc4c(-c4cccc(-c5ncco5)n4)c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cc34)n2)N1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.37
HPGDS O60760 1/20 0.30

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
SCHEMBL16159217 0.99 MCL1 (0.37) MCL1HPGDS
SCHEMBL16159190 0.98 MCL1 (0.38) MCL1HPGDS
SCHEMBL16159734 0.98 MCL1 (0.38) MCL1HPGDS
SCHEMBL16159713 0.92 MCL1 (0.33) MCL1
SCHEMBL16159719 0.91 KDM4E (0.33) MCL1
SCHEMBL16159256 0.90 ENPP1 (0.32) MCL1
SCHEMBL16159672 0.88 BRD4 (0.31)
SCHEMBL17704342 0.86 MCL1 (0.42) MCL1HPGDS
SCHEMBL17704341 0.85 MCL1 (0.43) MCL1HPGDS
SCHEMBL16159558 0.84 MCL1 (0.44) MCL1HPGDS

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
WO-2014163173-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC株式会社 (JP) 2014-10-09 WO disclosed