SCHEMBL16641306

SCHEMBL16641306

c1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5ccc6c(c5)c5cc7c(cc5n6-c5ccccc5)C5(c6ccccc6-c6ccccc65)c5ccccc5-7)cc4)ccc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ATM Q13315 1/20 0.45
TSPO P30536 1/20 0.34
HDAC4 P56524 1/20 0.34
PTGER4 P35408 1/20 0.33
PDK2 Q15119 2/20 0.32
KMT2A Q03164 2/20 0.32
IL1R1 P14778 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 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
SCHEMBL14822510 0.99 L3MBTL1 (0.46) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL24380016 0.96 KDM4E (0.42) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL15946306 0.96 L3MBTL1 (0.44) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL19196069 0.96 L3MBTL1 (0.44) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL20129508 0.95 L3MBTL1 (0.41) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL20007183 0.95 KDM4E (0.43) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL19653297 0.94 KDM4E (0.42) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL15582987 0.94 L3MBTL1 (0.44) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL18623568 0.93 KDM4E (0.41) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL14681625 0.93 KDM4E (0.41) L3MBTL1KDM4EATMTSPOHDAC4

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-20150105563-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-04-16 US disclosed
US-20150105563-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-04-16 US disclosed