SCHEMBL8819293

SCHEMBL8819293

c1ccc(-c2nc(-n3c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)nc3ccccc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
MAPT P10636 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 4/20 0.45
LMNA P02545 1/20 0.44
ATM Q13315 3/20 0.44
MAPK1 P28482 2/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PTGER4 P35408 1/20 0.39
NUDT1 P36639 3/20 0.38
ADORA2A P29274 2/20 0.38
NPY5R Q15761 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
GAA P10253 1/20 0.36
IL1R1 P14778 1/20 0.36

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
SCHEMBL29645234 0.97 KDM4E (0.49) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL10246658 0.97 KDM4E (0.49) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL6373649 0.96 KDM4E (0.46) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL15682488 0.96 KDM4E (0.46) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL8816146 0.96 KDM4E (0.46) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL16475779 0.96 KDM4E (0.48) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL15197764 0.96 KDM4E (0.48) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL15583014 0.96 KDM4E (0.48) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL22479831 0.96 KDM4E (0.48) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL16475838 0.96 KDM4E (0.48) KDM4EALDH1A1HPGDMAPTNPSR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140077179-A1 NOVEL COMPOUND FOR ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2014-03-20 US disclosed
US-20140077179-A1 NOVEL COMPOUND FOR ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2014-03-20 US disclosed
WO-2012067425-A1 NOVEL COMPOUND FOR ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2012-05-24 WO disclosed