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Sugi Predict / Compounds / SCHEMBL25966331

SCHEMBL25966331

SCHEMBL25966331

c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc6c(cc54)C4(c5ccccc5-c5ccccc54)c4ccccc4-6)c3)nc(-n3c4ccccc4c4ccccc43)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ABCG2 Q9UNQ0 1/20 0.31
▸ PDE10A Q9Y233 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
SCHEMBL25966416 1.00 KDM4E (0.35) KDM4EATML3MBTL1ABCG2PDE10A
SCHEMBL25966513 0.98 KDM4E (0.33) KDM4EATML3MBTL1ABCG2PDE10A
SCHEMBL25965971 0.98 KDM4E (0.33) KDM4EATML3MBTL1ABCG2PDE10A
SCHEMBL25966418 0.97 KDM4E (0.37) KDM4EATML3MBTL1ABCG2PDE10A
SCHEMBL15248706 0.97 KDM4E (0.37) KDM4EATML3MBTL1ABCG2PDE10A
SCHEMBL24078665 0.96 KDM4E (0.35) KDM4EATML3MBTL1ABCG2PDE10A
SCHEMBL25966405 0.96 KDM4E (0.35) KDM4EATML3MBTL1ABCG2PDE10A
SCHEMBL25966348 0.95 KDM4E (0.33) KDM4EATML3MBTL1ABCG2
SCHEMBL25966435 0.95 KDM4E (0.33) KDM4EATML3MBTL1ABCG2
SCHEMBL25121759 0.95 KDM4E (0.35) KDM4EATML3MBTL1PDE10A

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
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 — — US disclosed
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 — — US disclosed