SCHEMBL16613292

SCHEMBL16613292

c1ccc(-c2ccccc2-c2nc(-n3c4ccccc4c4ccccc43)nc3cn(-c4ccccc4)cc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.37
L3MBTL1 Q9Y468 4/20 0.37
ATM Q13315 1/20 0.37
ALDH1A1 P00352 4/20 0.35
HPGD P15428 3/20 0.35
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.33
HTT P42858 2/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
USP2 O75604 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
CASP1 P29466 1/20 0.31
CYP2C19 P33261 1/20 0.31
CASP7 P55210 1/20 0.31
HBB P68871 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
SCHEMBL16613298 0.90 KDM4E (0.44) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL16613296 0.89 KDM4E (0.31) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL16613320 0.88 KDM4E (0.36) KDM4EL3MBTL1ATMALDH1A1NPSR1
SCHEMBL16613318 0.88 KDM4E (0.37) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL16613319 0.88 KDM4E (0.43) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL16613293 0.87 KDM4E (0.40) KDM4EL3MBTL1ATMHTTMAPK1
SCHEMBL16613272 0.86 KDM4E (0.35) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL16613380 0.85 KDM4E (0.37) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL16613379 0.85 KDM4E (0.38) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL16613271 0.84 KDM4E (0.37) KDM4EL3MBTL1ATMALDH1A1HPGD

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