SCHEMBL16850110

SCHEMBL16850110

c1ccc2c(c1)ccc1cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6cc7c8ccccc8n8c9ccccc9c(c6)c78)cc5)ccc43)ccc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HDAC4 P56524 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HIF1A Q16665 1/20 0.33
CYP1B1 Q16678 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PDPK1 O15530 9/20 0.32
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
PRSS1 P07477 1/20 0.32
TSPO P30536 1/20 0.31
HPRT1 P00492 1/20 0.31
CA9 Q16790 1/20 0.31
PTGER4 P35408 1/20 0.30
PTGES O14684 1/20 0.30
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
MTOR P42345 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
SCHEMBL24795545 0.97 KDM4E (0.36) KDM4EATML3MBTL1ALDH1A1HIF1A
SCHEMBL16842473 0.93 KDM4E (0.36) KDM4EATML3MBTL1HDAC4ALDH1A1
SCHEMBL16850107 0.93 KDM4E (0.39) KDM4EATML3MBTL1HDAC4ALDH1A1
SCHEMBL24795031 0.93 KDM4E (0.36) KDM4EATML3MBTL1ALDH1A1HIF1A
SCHEMBL16850098 0.93 KDM4E (0.39) KDM4EATML3MBTL1HDAC4ALDH1A1
SCHEMBL15479753 0.89 KDM4E (0.46) KDM4EATML3MBTL1HDAC4ALDH1A1
SCHEMBL31450379 0.88 KDM4E (0.41) KDM4EATML3MBTL1HDAC4ALDH1A1
SCHEMBL15480231 0.88 KDM4E (0.43) KDM4EATML3MBTL1ALDH1A1HIF1A
SCHEMBL16850114 0.88 KDM4E (0.37) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL16850077 0.88 KDM4E (0.36) KDM4EATML3MBTL1HDAC4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150179955-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-25 US disclosed
US-20150179955-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-25 US disclosed