SCHEMBL17989809

SCHEMBL17989809

c1ccc(-n2c3c4ccccc4ccc3c3ccc4c(c5ccccc5n4-c4cccc5ccccc45)c32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
ALDH1A1 P00352 4/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
CYP1A2 P05177 3/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
GSR P00390 1/20 0.32
HPGD P15428 2/20 0.32
POLB P06746 1/20 0.31
NPC1 O15118 1/20 0.31
MAPK1 P28482 1/20 0.31
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31

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
SCHEMBL17990360 0.94 KDM4E (0.42) KDM4EATML3MBTL1TDP1ALDH1A1
SCHEMBL17989804 0.92 KDM4E (0.44) KDM4EATML3MBTL1TDP1CNR1
SCHEMBL17245392 0.92 KDM4E (0.46) KDM4EATML3MBTL1TDP1CNR1
SCHEMBL17245387 0.91 KDM4E (0.51) KDM4EATML3MBTL1TDP1CNR1
SCHEMBL17989782 0.90 KDM4E (0.50) KDM4EATML3MBTL1TDP1ALDH1A1
SCHEMBL26154859 0.88 KDM4E (0.39) KDM4EATML3MBTL1TDP1CNR1
SCHEMBL17989791 0.88 KDM4E (0.42) KDM4EATML3MBTL1TDP1CNR1
SCHEMBL21675966 0.88 L3MBTL1 (0.35) KDM4EATML3MBTL1TDP1ALDH1A1
SCHEMBL27451865 0.88 KDM4E (0.50) KDM4EATML3MBTL1TDP1CNR1
SCHEMBL2741409 0.87 TDP1 (0.41) KDM4EATML3MBTL1TDP1CNR1

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-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed