SCHEMBL26420962

SCHEMBL26420962

c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-n4c5ccccc5c5c(-c6ccc(-c7ccccc7)cc6)c(-c6ccc(-c7ccccc7)cc6)c6c7ccccc7n(-c7ccccc7)c6c54)n3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
AVPR1A P37288 1/20 0.33

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
SCHEMBL26420967 1.00 KMT2A (0.37) KMT2AKDM4EATML3MBTL1ABCG2
SCHEMBL26420944 1.00 KMT2A (0.37) KMT2AKDM4EATML3MBTL1ABCG2
SCHEMBL26420968 1.00 KMT2A (0.37) KMT2AKDM4EATML3MBTL1ABCG2
SCHEMBL24549585 1.00 KMT2A (0.37) KMT2AKDM4EATML3MBTL1ABCG2
SCHEMBL24549696 0.99 KMT2A (0.36) KMT2AKDM4EATML3MBTL1ABCG2
SCHEMBL26420976 0.99 KMT2A (0.36) KMT2AKDM4EATML3MBTL1ABCG2
SCHEMBL24549531 0.99 KMT2A (0.38) KMT2AKDM4EATML3MBTL1ABCG2
SCHEMBL26420957 0.99 KMT2A (0.38) KMT2AKDM4EATML3MBTL1ABCG2
SCHEMBL26420949 0.99 KMT2A (0.38) KMT2AKDM4EATML3MBTL1ABCG2
SCHEMBL24549582 0.98 KMT2A (0.37) KMT2AKDM4EATML3MBTL1ABCG2

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