Sugi Predict

Sugi Predict / Compounds / SCHEMBL24949535

SCHEMBL24949535

SCHEMBL24949535

c1ccc(-c2ccc(-c3ccc(N(c4ccccc4-c4ccccc4)c4ccccc4-c4cccc(-n5c6ccccc6c6c7ccccc7ccc65)c4)cc3)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 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
SCHEMBL24949524 0.98 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL24946964 0.94 CA12 (0.36) KDM4EATML3MBTL1PDE10ACA12
SCHEMBL24948714 0.93 PDE10A (0.32) KDM4EATML3MBTL1PDE10A
SCHEMBL24948198 0.93 KDM4E (0.31) KDM4EATML3MBTL1CA12CA1
SCHEMBL24948155 0.93 KDM4E (0.31) KDM4EATML3MBTL1CA12CA1
SCHEMBL24948038 0.92 PDE10A (0.31) PDE10ACA12CA1CA2CA9
SCHEMBL24946833 0.92 KDM4E (0.35) KDM4EATML3MBTL1
SCHEMBL24946993 0.91 KDM4E (0.35) KDM4EATML3MBTL1
SCHEMBL24947101 0.91 CA12 (0.34) PDE10ACA12CA1CA2CA9
SCHEMBL24948712 0.91 CA12 (0.34) CA12CA1CA2CA9

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