SCHEMBL16768567

SCHEMBL16768567

Nc1c(Nc2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccncc2c2cnccc12

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.40
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAOA P21397 4/20 0.38
MAOB P27338 4/20 0.38
ACHE P22303 1/20 0.38
TDO2 P48775 9/20 0.38
CDK4 P11802 1/20 0.38
CDK6 Q00534 1/20 0.38
SLC6A2 P23975 1/20 0.35
CYP17A1 P05093 1/20 0.35
KDM1A O60341 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
SCHEMBL16768562 0.81 IDO1 (0.57) IDO1TDO2KDM1A
SCHEMBL15263336 0.74 KDM4E (0.48) IDO1KDM4EATML3MBTL1MAOA
SCHEMBL16768564 0.74 TDO2 (0.58) IDO1TDO2
SCHEMBL5061713 0.73 KDM4E (0.41) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL30476140 0.72 L3MBTL1 (0.64) KDM4EATML3MBTL1SLC6A2CYP17A1
SCHEMBL10307238 0.72 L3MBTL1 (0.64) KDM4EATML3MBTL1SLC6A2CYP17A1
SCHEMBL16768570 0.72 TDO2 (0.48) IDO1TDO2
SCHEMBL4570443 0.70 MAOA (0.53) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL261830 0.70 KDM4E (0.52) IDO1KDM4EATML3MBTL1MAOA
SCHEMBL15907062 0.70 MAOA (0.53) KDM4EATML3MBTL1MAOAMAOB

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-9666809-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-30 US disclosed
US-9666809-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-30 US disclosed
US-20150155497-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-04 US disclosed
US-20150155497-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-04 US disclosed