SCHEMBL16613473

SCHEMBL16613473

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4nc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)c5occc5n4)ccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ATM Q13315 1/20 0.36
PTGER4 P35408 1/20 0.34
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
RORC P51449 1/20 0.30
DUSP3 P51452 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
SCHEMBL16613614 0.92 KDM4E (0.40) KDM4EL3MBTL1ATMMEN1ALDH1A1
SCHEMBL16613308 0.91 KDM4E (0.37) KDM4EL3MBTL1ATMPTGER4MEN1
SCHEMBL16613399 0.89 KDM4E (0.40) KDM4EL3MBTL1ATMPTGER4MEN1
SCHEMBL16613472 0.88 KDM4E (0.35) KDM4EL3MBTL1ATMPTGER4ALDH1A1
SCHEMBL16613500 0.88 KDM4E (0.38) KDM4EL3MBTL1ATMPTGER4MEN1
SCHEMBL16613471 0.88 KDM4E (0.39) KDM4EL3MBTL1ATMPTGER4MEN1
SCHEMBL16613400 0.87 KDM4E (0.33) KDM4EL3MBTL1ATMPTGER4ALDH1A1
SCHEMBL16613392 0.86 ALOX5 (0.35) KDM4EL3MBTL1ATMPTGER4PIK3CD
SCHEMBL16613580 0.86 KDM4E (0.36) KDM4EL3MBTL1ATMPTGER4DUSP3
SCHEMBL16613401 0.86 KDM4E (0.38) KDM4EL3MBTL1ATMPTGER4MEN1

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed