SCHEMBL25965341

SCHEMBL25965341

c1ccc(-c2cccc3oc4cc(-c5nc(-n6c7ccccc7c7ccccc76)nc(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)n5)ccc4c23)cc1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
BACE1 P56817 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
SCHEMBL25965020 0.97 KDM4E (0.31) KDM4EATML3MBTL1BACE1
SCHEMBL24078422 0.97 KDM4E (0.33) KDM4EATML3MBTL1BACE1
SCHEMBL25965363 0.95 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL25965359 0.95 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL25965333 0.95 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL25965328 0.95 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL25965036 0.94 KDM4E (0.33) KDM4EATML3MBTL1BACE1
SCHEMBL25965288 0.93 KDM4E (0.33) KDM4EATML3MBTL1BACE1
SCHEMBL25965326 0.93 KDM4E (0.36) KDM4EATML3MBTL1BACE1
SCHEMBL24390354 0.93 PDE10A (0.31)

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