SCHEMBL16285622

SCHEMBL16285622

c1ccc(-c2cccc(-n3c4cccc5ccc6c(-c7ccc8c(c7)c7ccccc7n8-c7nc(-c8ccccc8)cc(-c8ccccc8)n7)ccc3c6c54)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.31
▸ GABRG2 P18507 1/20 0.31
▸ GABRB3 P28472 1/20 0.31
▸ GABRA5 P31644 1/20 0.31
▸ GABRA3 P34903 1/20 0.31
▸ TSPO P30536 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
SCHEMBL16283258 0.96 KDM4E (0.36) PTGESKDM4EATML3MBTL1
SCHEMBL16283312 0.96 KDM4E (0.36) PTGESKDM4EATML3MBTL1
SCHEMBL16283259 0.95 KDM4E (0.37) PTGESKDM4EATML3MBTL1
SCHEMBL16283310 0.95 KDM4E (0.37) PTGESKDM4EATML3MBTL1
SCHEMBL16283324 0.94 KDM4E (0.35) PTGESKDM4EATML3MBTL1
SCHEMBL16285641 0.94 PTGES (0.33) PTGES
SCHEMBL16285629 0.94 PTGES (0.34) PTGESKDM4EATML3MBTL1
SCHEMBL16283314 0.93 PTGES (0.36) PTGESKDM4EL3MBTL1
SCHEMBL16285632 0.92 CYP1A1 (0.34) PTGESKDM4EL3MBTL1
SCHEMBL16283280 0.92 KDM4E (0.36) PTGESKDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9368730-B2 Heterocyclic compound and organic light-emitting device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-14 — — US disclosed
US-9368730-B2 Heterocyclic compound and organic light-emitting device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-14 — — US disclosed
US-20140361254-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-12-11 — — US disclosed
US-20140361254-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-12-11 — — US disclosed
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