SCHEMBL16613462

SCHEMBL16613462

c1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)nc4occc34)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
ATM Q13315 1/20 0.39
NPY5R Q15761 1/20 0.35
PTGER4 P35408 1/20 0.34
TSPO P30536 1/20 0.33
ALDH1A1 P00352 4/20 0.32
HPGD P15428 2/20 0.32
MAPT P10636 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HDAC4 P56524 1/20 0.31
KMT2A Q03164 2/20 0.30
LMNA P02545 1/20 0.30
PIK3R1 P27986 1/20 0.30
PIK3CA P42336 1/20 0.30
IL1R1 P14778 1/20 0.30
MEN1 O00255 1/20 0.30
HTT P42858 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
SCHEMBL16613491 0.99 KDM4E (0.40) KDM4EL3MBTL1ATMNPY5RPTGER4
SCHEMBL16613536 0.96 KDM4E (0.38) KDM4EL3MBTL1ATMNPY5RPTGER4
SCHEMBL16613579 0.91 KDM4E (0.37) KDM4EL3MBTL1ATMNPY5RPTGER4
SCHEMBL16613493 0.90 KDM4E (0.35) KDM4EL3MBTL1ATMNPY5RPTGER4
SCHEMBL16613537 0.88 KDM4E (0.33) KDM4EL3MBTL1ATMPTGER4
SCHEMBL16613580 0.88 KDM4E (0.36) KDM4EL3MBTL1ATMPTGER4
SCHEMBL16613492 0.88 KDM4E (0.36) KDM4EL3MBTL1ATMPTGER4ALDH1A1
SCHEMBL16613463 0.87 NPY5R (0.40) KDM4EL3MBTL1ATMNPY5RPTGER4
SCHEMBL16613471 0.85 KDM4E (0.39) KDM4EL3MBTL1ATMNPY5RPTGER4
SCHEMBL15638499 0.84 KDM4E (0.48) KDM4EL3MBTL1ATMNPY5RPTGER4

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