SCHEMBL26420920

SCHEMBL26420920

c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-n4c5ccc(-c6ccccc6)cc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)n3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PTGER4 P35408 1/20 0.37
TSPO P30536 2/20 0.34
ABCG2 Q9UNQ0 1/20 0.34
NPY5R Q15761 1/20 0.33
NR3C1 P04150 1/20 0.33
AVPR1A P37288 1/20 0.33
KMT2A Q03164 1/20 0.32

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
SCHEMBL26420831 1.00 KDM4E (0.39) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL26420921 1.00 KDM4E (0.39) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL26420918 1.00 KDM4E (0.39) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL26420833 1.00 KDM4E (0.39) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL26420825 1.00 KDM4E (0.39) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL24994180 1.00 KDM4E (0.39) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL26420820 0.99 KDM4E (0.40) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL26420912 0.99 KDM4E (0.40) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL15181230 0.99 KDM4E (0.40) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL26420837 0.98 KDM4E (0.36) KDM4EATML3MBTL1PTGER4TSPO

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-20230128732-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL AND ORGANIC ELECTROLUMINESCENCE ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-04-27 US disclosed
US-20230128732-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL AND ORGANIC ELECTROLUMINESCENCE ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-04-27 US disclosed