SCHEMBL17809373

SCHEMBL17809373

c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccc(-c7cccc(-c8ccccc8)c7)cc6)c45)n3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.34
KDM4E B2RXH2 3/20 0.34
ATM Q13315 1/20 0.34
NR3C1 P04150 1/20 0.34
MAPT P10636 4/20 0.32
MAPK1 P28482 3/20 0.32
NPSR1 Q6W5P4 2/20 0.32
HTT P42858 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
DHODH Q02127 1/20 0.32
HDAC4 P56524 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30
DHFR P00374 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
NTSR1 P30989 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
SCHEMBL19769897 0.97 KDM4E (0.36) L3MBTL1KDM4EATMNR3C1MAPT
SCHEMBL19769894 0.96 KDM4E (0.37) L3MBTL1KDM4EATMMAPTMAPK1
SCHEMBL19769898 0.94 L3MBTL1 (0.38) L3MBTL1KDM4EATMMAPTMAPK1
SCHEMBL15625697 0.94 L3MBTL1 (0.40) L3MBTL1KDM4EATMMAPTMAPK1
SCHEMBL17248251 0.94 L3MBTL1 (0.40) L3MBTL1KDM4EATMMAPTMAPK1
SCHEMBL16260433 0.94 L3MBTL1 (0.38) L3MBTL1KDM4EATMNR3C1MAPT
SCHEMBL17248253 0.93 L3MBTL1 (0.41) L3MBTL1KDM4EATMMAPTMAPK1
SCHEMBL19769866 0.92 KDM4E (0.39) L3MBTL1KDM4EATMNR3C1MAPT
SCHEMBL17248249 0.92 GABRG2 (0.35) L3MBTL1KDM4EATMMAPTMAPK1
SCHEMBL18058647 0.92 L3MBTL1 (0.40) L3MBTL1KDM4EATMNR3C1MAPT

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-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed
US-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed