SCHEMBL21894741

SCHEMBL21894741

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6ccc(-c7cccc8c7c7ccc(-c9cccc(-n%10c%11ccccc%11c%11ccccc%11%10)c9)cc7n8-c7ccccc7)cc6)c5c4)ccc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ATM Q13315 1/20 0.44
HDAC4 P56524 1/20 0.36
MAPK14 Q16539 1/20 0.34
KMT2A Q03164 3/20 0.33
TSPO P30536 1/20 0.33
IL1R1 P14778 1/20 0.33
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
PTGER4 P35408 1/20 0.32
PDE10A Q9Y233 1/20 0.32
JAK2 O60674 1/20 0.32
JAK3 P52333 1/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
ALK Q9UM73 2/20 0.31
DNM1 Q05193 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
SCHEMBL20780504 0.99 L3MBTL1 (0.43) L3MBTL1KDM4EATMHDAC4MAPK14
SCHEMBL25671993 0.99 L3MBTL1 (0.43) L3MBTL1KDM4EATMHDAC4MAPK14
SCHEMBL25671995 0.98 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4MAPK14
SCHEMBL20654998 0.96 L3MBTL1 (0.43) L3MBTL1KDM4EATMHDAC4MAPK14
SCHEMBL21928049 0.96 L3MBTL1 (0.47) L3MBTL1KDM4EATMHDAC4MAPK14
SCHEMBL20655021 0.95 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL22590235 0.94 L3MBTL1 (0.41) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL26768030 0.94 L3MBTL1 (0.43) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL20006904 0.94 L3MBTL1 (0.43) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL21310207 0.94 L3MBTL1 (0.45) L3MBTL1KDM4EATMHDAC4MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10593886-B2 OLED devices with improved lifetime using non-crystallizable molecular glass mixture hosts MOLECULAR GLASSES, INC. (US) 2020-03-17 US disclosed