SCHEMBL22958719

SCHEMBL22958719

c1ccc2c(c1)Oc1cccc3c1N2c1ccc(-c2ccc(-n4c5ccccc5c5ccccc54)cc2)cc1O3

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
EDNRA P25101 2/20 0.35
EDNRB P24530 1/20 0.35
HDAC4 P56524 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
P2RX4 Q99571 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL22958727 0.95 L3MBTL1 (0.42) L3MBTL1KDM4EATMEDNRAEDNRB
SCHEMBL12333420 0.92 L3MBTL1 (0.41) L3MBTL1KDM4EATMEDNRAEDNRB
SCHEMBL22958722 0.91 L3MBTL1 (0.43) L3MBTL1KDM4EATMEDNRAEDNRB
SCHEMBL22958735 0.90 EDNRB (0.37) L3MBTL1KDM4EATMEDNRAEDNRB
SCHEMBL12333543 0.90 L3MBTL1 (0.46) L3MBTL1KDM4EATMEDNRAEDNRB
SCHEMBL22958711 0.89 KDM4E (0.40) L3MBTL1KDM4EATMEDNRAEDNRB
SCHEMBL19035949 0.89 KDM4E (0.41) L3MBTL1KDM4EATMEDNRAEDNRB
SCHEMBL19036007 0.89 KDM4E (0.38) L3MBTL1KDM4EATMEDNRAEDNRB
SCHEMBL22958792 0.89 L3MBTL1 (0.45) L3MBTL1KDM4EATMEDNRAEDNRB
SCHEMBL22958694 0.88 CA12 (0.34) L3MBTL1KDM4EATMHDAC4

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-20210043852-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-02-11 US disclosed