SCHEMBL22705758

SCHEMBL22705758

c1ccc(-c2ccc3c(-c4c5cccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)c5cc5c(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cccc45)cccc3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
HSD17B1 P14061 3/20 0.34
HSD17B2 P37059 3/20 0.34
KMT2A Q03164 2/20 0.34
TSPO P30536 1/20 0.34
NTSR1 P30989 1/20 0.34
MCL1 Q07820 1/20 0.33
ACMSD Q8TDX5 1/20 0.33
PTGER4 P35408 1/20 0.33
MAPK14 Q16539 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
HDAC4 P56524 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL22705760 0.94 L3MBTL1 (0.42) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22706602 0.93 L3MBTL1 (0.41) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22706591 0.93 KDM4E (0.43) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22708161 0.92 L3MBTL1 (0.42) L3MBTL1KDM4EATMCA12CA1
SCHEMBL24004110 0.92 KDM4E (0.44) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22627947 0.92 KDM4E (0.44) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22706369 0.92 KDM4E (0.46) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22707262 0.90 L3MBTL1 (0.44) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22707030 0.89 L3MBTL1 (0.49) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL22707469 0.88 L3MBTL1 (0.43) L3MBTL1KDM4EATMCA12CA1

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-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed