SCHEMBL16369552

SCHEMBL16369552

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccc(-c5ccccc5)c5ccc6c(-c7ccc8c9c7ccc7c(-c%10ccccc%10)ccc(c79)n8-c7ccccc7)ccc3c6c54)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.36
▸ MAPK1 P28482 7/20 0.35
▸ MAPT P10636 6/20 0.35
▸ L3MBTL1 Q9Y468 5/20 0.35
▸ KDM4E B2RXH2 5/20 0.35
▸ NPSR1 Q6W5P4 3/20 0.35
▸ ACHE P22303 1/20 0.35
▸ MKNK1 Q9BUB5 1/20 0.35
▸ MKNK2 Q9HBH9 1/20 0.35
▸ ALDH1A1 P00352 5/20 0.35
▸ ADORA2A P29274 4/20 0.35
▸ ADORA1 P30542 4/20 0.35
▸ HPGD P15428 4/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ ADORA3 P0DMS8 3/20 0.34
▸ TDP1 Q9NUW8 3/20 0.34
▸ LMNA P02545 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34

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
SCHEMBL16369549 0.90 KDM4E (0.33) GRM5MAPK1MAPTL3MBTL1KDM4E
SCHEMBL16369550 0.88 CYP1A1 (0.34) MAPK1MAPTL3MBTL1KDM4ENPSR1
SCHEMBL16369520 0.86 MEN1 (0.37) MAPK1L3MBTL1KDM4ENPSR1ALDH1A1
SCHEMBL16369553 0.85 CYP1A1 (0.32) MAPK1MAPTL3MBTL1KDM4ENPSR1
SCHEMBL2754625 0.85 L3MBTL1 (0.47) MAPK1MAPTL3MBTL1KDM4ENPSR1
SCHEMBL16369561 0.84 MAPT (0.34) GRM5MAPK1MAPTL3MBTL1KDM4E
SCHEMBL16283259 0.83 KDM4E (0.37) MAPK1MAPTL3MBTL1KDM4ENPSR1
SCHEMBL16283310 0.83 KDM4E (0.37) MAPK1MAPTL3MBTL1KDM4ENPSR1
SCHEMBL16283328 0.83 KDM4E (0.37) MAPK1MAPTL3MBTL1KDM4ENPSR1
SCHEMBL16369551 0.83 KDM4E (0.37) MAPTL3MBTL1KDM4EALDH1A1HPGD

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-9437827-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-09-06 — — US disclosed
US-9437827-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-09-06 — — US disclosed
US-20150001493-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-01-01 — — US disclosed
US-20150001493-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-01-01 — — US disclosed
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