SCHEMBL24949518

SCHEMBL24949518

c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4cc5c6ccccc6ccc5c5ccccc45)cc3)c3ccccc3-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPRT1 P00492 3/20 0.33
HDAC4 P56524 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.30
SIRT1 Q96EB6 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
SCHEMBL24946711 0.98 KDM4E (0.36) KDM4EATML3MBTL1HPRT1HDAC4
SCHEMBL24946683 0.97 KDM4E (0.37) KDM4EATML3MBTL1HPRT1HDAC4
SCHEMBL24947005 0.94 HPRT1 (0.31) KDM4EATML3MBTL1HPRT1CYP1A2
SCHEMBL24949719 0.93 KDM4E (0.38) KDM4EATML3MBTL1HPRT1CYP1A2
SCHEMBL24948878 0.93 KDM4E (0.34) KDM4EATML3MBTL1HPRT1CYP1A2
SCHEMBL24949528 0.91 KDM4E (0.36) KDM4EATML3MBTL1HPRT1HDAC4
SCHEMBL24946691 0.91 KDM4E (0.36) KDM4EATML3MBTL1HPRT1HDAC4
SCHEMBL24949729 0.91 KDM4E (0.36) KDM4EATML3MBTL1HPRT1HDAC4
SCHEMBL26058161 0.91 KDM4E (0.37) KDM4EATML3MBTL1HPRT1CYP1A2
SCHEMBL24946618 0.90 KDM4E (0.35) KDM4EATML3MBTL1HPRT1HDAC4

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