SCHEMBL8817653

SCHEMBL8817653

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5cc7c8ccccc8n(-c8ccccc8)c7cc5n6-c5ccccc5)ccc43)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.46
KDM4E B2RXH2 4/20 0.46
ATM Q13315 1/20 0.46
PTGER4 P35408 1/20 0.38
MAPT P10636 6/20 0.36
MAPK1 P28482 6/20 0.36
HTT P42858 3/20 0.36
NPSR1 Q6W5P4 3/20 0.36
NPY5R Q15761 1/20 0.35
KMT2A Q03164 6/20 0.35
IL1R1 P14778 1/20 0.35
TSPO P30536 1/20 0.34
ALDH1A1 P00352 6/20 0.34
MEN1 O00255 5/20 0.34
HPGD P15428 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
NTSR1 P30989 1/20 0.34
PTGES O14684 1/20 0.33

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
SCHEMBL8818131 0.96 L3MBTL1 (0.47) L3MBTL1KDM4EATMPTGER4MAPT
SCHEMBL15371713 0.96 L3MBTL1 (0.50) L3MBTL1KDM4EATMPTGER4MAPT
SCHEMBL29803179 0.96 L3MBTL1 (0.50) L3MBTL1KDM4EATMPTGER4MAPT
SCHEMBL6373241 0.96 L3MBTL1 (0.50) L3MBTL1KDM4EATMPTGER4MAPT
SCHEMBL6374184 0.95 L3MBTL1 (0.46) L3MBTL1KDM4EATMPTGER4MAPT
SCHEMBL30100155 0.95 L3MBTL1 (0.46) L3MBTL1KDM4EATMPTGER4MAPT
SCHEMBL6373688 0.95 L3MBTL1 (0.46) L3MBTL1KDM4EATMPTGER4MAPT
SCHEMBL19769708 0.95 L3MBTL1 (0.49) L3MBTL1KDM4EATMPTGER4MAPT
SCHEMBL19769733 0.95 L3MBTL1 (0.49) L3MBTL1KDM4EATMPTGER4MAPT
SCHEMBL18213902 0.95 L3MBTL1 (0.49) L3MBTL1KDM4EATMPTGER4MAPT

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