SCHEMBL20066416

SCHEMBL20066416

Cn1c2cccc(-c3ccc4c(c3)N(c3ccccc3)c3ccccc3C4(C)C)c2c2c3ccccc3ccc21

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
PDE6D O43924 1/20 0.32
PGR P06401 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL20065778 0.86 PDE6D (0.30) PDE6D
SCHEMBL20065783 0.86 PDE6D (0.32) PDE6D
SCHEMBL20065782 0.86 PDE6D (0.32) PDE6D
SCHEMBL20065780 0.86 FLT3 (0.31) MAPTKDM4EPDE6D
SCHEMBL20065529 0.84 ALDH1A1 (0.33) MAPTKMT2AKDM4E
SCHEMBL20065781 0.84 MAPT (0.31) MAPTMAPK1
SCHEMBL20065777 0.84 MAPT (0.31) MAPTMAPK1PDE6D
SCHEMBL20065785 0.84 MAPT (0.31) MAPTMAPK1PDE6D
SCHEMBL20065532 0.84 ALDH1A1 (0.32) MAPTKMT2AKDM4EPDE6D
SCHEMBL20065536 0.83 KDM4E (0.32) MAPTKMT2AKDM4E

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-2018070835-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 주식회사 두산 2018-04-19 WO disclosed