SCHEMBL24948642

SCHEMBL24948642

CC1(C)c2ccccc2-c2c(N(c3ccc(-c4ccccc4)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cccc21

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HDAC4 P56524 1/20 0.35
TSPO P30536 1/20 0.31
KMT2A Q03164 1/20 0.31
GSK3B P49841 1/20 0.31
PDK2 Q15119 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
SCHEMBL14681496 1.00 KDM4E (0.37) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL20232362 0.99 KDM4E (0.36) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL20009768 0.98 KDM4E (0.35) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL15892438 0.98 KDM4E (0.37) KDM4EATML3MBTL1HDAC4PDK2
SCHEMBL22648582 0.98 KDM4E (0.36) KDM4EATML3MBTL1HDAC4PDK2
SCHEMBL21446241 0.97 KDM4E (0.35) KDM4EATML3MBTL1HDAC4PDK2
SCHEMBL24947574 0.96 KDM4E (0.34) KDM4EATML3MBTL1HDAC4
SCHEMBL24948524 0.95 KDM4E (0.33) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL24221718 0.95 TSPO (0.39) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL24948644 0.94 KDM4E (0.40) KDM4EATML3MBTL1HDAC4PDK2

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