SCHEMBL24948834

SCHEMBL24948834

c1ccc(-c2ccc(N(c3ccc(-c4cc(-n5c6ccccc6c6cc7ccccc7cc65)ccc4-c4ccccc4)cc3)c3ccc(-c4cccc5ccccc45)cc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
PPARG P37231 8/20 0.33
PPARA Q07869 8/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
PPARD Q03181 1/20 0.32
MCL1 Q07820 1/20 0.32
ACMSD Q8TDX5 1/20 0.32
ALK Q9UM73 1/20 0.32
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
NTSR1 P30989 2/20 0.31
MAPK14 Q16539 1/20 0.31

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
SCHEMBL24948961 0.96 CA12 (0.35) CA12CA1CA2CA9PPARG
SCHEMBL24948745 0.94 CA12 (0.39) CA12CA1CA2CA9PPARG
SCHEMBL24948771 0.94 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL16356658 0.93 KDM4E (0.39) CA12CA1CA2CA9PPARG
SCHEMBL24947273 0.93 KDM4E (0.39) CA12CA1CA2CA9PPARG
SCHEMBL24374036 0.92 CA12 (0.36) CA12CA1CA2CA9PPARG
SCHEMBL21370008 0.91 KDM4E (0.39) CA12CA1CA2CA9PPARG
SCHEMBL24948739 0.90 CA12 (0.39) CA12CA1CA2CA9PPARG
SCHEMBL24948611 0.90 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL20258134 0.90 KDM4E (0.40) CA12CA1CA2CA9PPARG

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