Sugi Predict

Sugi Predict / Compounds / SCHEMBL24947138

SCHEMBL24947138

SCHEMBL24947138

c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccc6c7ccccc7ccc6c5c4)cc3)c3ccccc3-c3cccc(-n4c5ccccc5c5ccccc54)c3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.33
▸ TSPO P30536 1/20 0.32
▸ 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
SCHEMBL24949527 0.95 KDM4E (0.32) KDM4EATML3MBTL1PDE10ATSPO
SCHEMBL24946940 0.93 KDM4E (0.34) KDM4EATML3MBTL1PDE10ACA12
SCHEMBL24948852 0.92 KDM4E (0.35) KDM4EATML3MBTL1PDE10ACA12
SCHEMBL24949528 0.92 KDM4E (0.36) KDM4EATML3MBTL1TSPOCA12
SCHEMBL25089074 0.91 KDM4E (0.37) KDM4EATML3MBTL1TSPOCA12
SCHEMBL24948878 0.91 KDM4E (0.34) KDM4EATML3MBTL1PDE10ACA12
SCHEMBL25088838 0.91 KDM4E (0.37) KDM4EATML3MBTL1TSPOCA12
SCHEMBL24749480 0.91 CA12 (0.34) KDM4EATML3MBTL1PDE10ACA12
SCHEMBL24749188 0.91 CA12 (0.34) KDM4EATML3MBTL1PDE10ACA12
SCHEMBL24948873 0.90 KDM4E (0.37) KDM4EATML3MBTL1PDE10ATSPO

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