SCHEMBL25965266

SCHEMBL25965266

c1ccc(-c2cccc(-c3ccc4c(c3)oc3cc(-c5nc(-c6ccccc6)nc(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)n5)ccc34)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ABCG2 Q9UNQ0 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
SCHEMBL24801436 0.98 KDM4E (0.34) KDM4EATML3MBTL1
SCHEMBL19769906 0.95 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL20315831 0.94 MMP12 (0.32) ATM
SCHEMBL25010835 0.94 MMP12 (0.32) ATM
SCHEMBL23602170 0.94 KDM4E (0.37) KDM4EATML3MBTL1
SCHEMBL19769905 0.94 KDM4E (0.34) KDM4EATML3MBTL1
SCHEMBL23118629 0.94 KDM4E (0.37) KDM4EATML3MBTL1ABCG2
SCHEMBL19769907 0.94 KDM4E (0.37) KDM4EATML3MBTL1ABCG2
SCHEMBL24549610 0.94 KDM4E (0.37) KDM4EATML3MBTL1ABCG2
SCHEMBL26473051 0.93 HCRTR1 (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