Sugi Predict

Sugi Predict / Compounds / SCHEMBL24948862

SCHEMBL24948862

SCHEMBL24948862

c1ccc(-c2cccc(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3ccccc3-c3cccc(-n4c5ccccc5c5ccccc54)c3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.32
▸ CYP11B1 P15538 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
SCHEMBL24946893 0.96 KDM4E (0.36) KDM4EATML3MBTL1PDE10ACYP11B1
SCHEMBL24949523 0.94 KDM4E (0.35) KDM4EATML3MBTL1CYP11B1
SCHEMBL24949366 0.93 KDM4E (0.34) KDM4EATML3MBTL1PDE10ACYP11B1
SCHEMBL24949289 0.92 KDM4E (0.32) KDM4EATML3MBTL1PDE10A
SCHEMBL21971419 0.92 GPR84 (0.31) KDM4EATML3MBTL1PDE10ACYP11B1
SCHEMBL24949286 0.92 HSD17B1 (0.33) KDM4EATML3MBTL1PDE10A
SCHEMBL24751183 0.92 KDM4E (0.35) KDM4EATML3MBTL1PDE10ACYP11B1
SCHEMBL24947146 0.92 KDM4E (0.38) KDM4EATML3MBTL1PDE10ACYP11B1
SCHEMBL21971546 0.92 KDM4E (0.38) KDM4EATML3MBTL1PDE10ACYP11B1
SCHEMBL21971552 0.92 KDM4E (0.38) KDM4EATML3MBTL1PDE10ACYP11B1

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