SCHEMBL24949237

SCHEMBL24949237

c1ccc(-c2cc(-c3cccc4ccccc34)ccc2N(c2ccccc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MCL1 Q07820 1/20 0.36
ACMSD Q8TDX5 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
EDNRB P24530 1/20 0.34
EDNRA P25101 1/20 0.34
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
MAPK14 Q16539 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
TNF P01375 1/20 0.32
NTSR1 P30989 2/20 0.32
FLT3 P36888 1/20 0.32
BMX P51813 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
SCHEMBL24948042 0.98 KDM4E (0.38) KDM4EATML3MBTL1MCL1ACMSD
SCHEMBL24949507 0.95 CA12 (0.40) KDM4EATML3MBTL1MCL1ACMSD
SCHEMBL21971502 0.95 CA12 (0.40) KDM4EATML3MBTL1MCL1ACMSD
SCHEMBL24948824 0.93 CA12 (0.36) KDM4EATML3MBTL1MCL1ACMSD
SCHEMBL21970746 0.93 KDM4E (0.39) KDM4EATML3MBTL1MCL1ACMSD
SCHEMBL24947047 0.93 CA12 (0.34) KDM4EATML3MBTL1MCL1ACMSD
SCHEMBL24949268 0.92 MCL1 (0.36) KDM4EATML3MBTL1MCL1ACMSD
SCHEMBL24947025 0.92 MCL1 (0.32) KDM4EATML3MBTL1MCL1ACMSD
SCHEMBL24948854 0.91 CA12 (0.39) KDM4EATML3MBTL1MCL1ACMSD
SCHEMBL24948821 0.91 MCL1 (0.36) KDM4EATML3MBTL1MCL1ACMSD

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
WO-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed
WO-2023003403-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed