SCHEMBL22708161

SCHEMBL22708161

c1ccc(-c2ccc3cccc(-c4c5cccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)c5cc5c(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cccc45)c3c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
KMT2A Q03164 2/20 0.34
TSPO P30536 1/20 0.34
MCL1 Q07820 1/20 0.34
ACMSD Q8TDX5 1/20 0.34
PTGER4 P35408 1/20 0.33
PTGES O14684 1/20 0.33
NTSR1 P30989 2/20 0.32
HDAC4 P56524 1/20 0.32
IL1R1 P14778 1/20 0.32
TLR4 O00206 1/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL22708162 0.94 L3MBTL1 (0.41) L3MBTL1KDM4EATMCA12CA1
SCHEMBL23266760 0.94 L3MBTL1 (0.45) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22705756 0.93 L3MBTL1 (0.44) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22627947 0.93 KDM4E (0.44) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22706369 0.93 KDM4E (0.46) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22705758 0.92 L3MBTL1 (0.41) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22707232 0.92 KDM4E (0.35) L3MBTL1KDM4EATMCA12CA1
SCHEMBL24004111 0.92 L3MBTL1 (0.45) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22707262 0.91 L3MBTL1 (0.44) L3MBTL1KDM4EATMCA12CA1
SCHEMBL22707030 0.90 L3MBTL1 (0.49) L3MBTL1KDM4EATMKMT2ATSPO

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