SCHEMBL24923926

SCHEMBL24923926

c1cc(-c2ccc3c(c2)c2ccccc2n3-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3cc(-n4c5ccccc5c5c(-n6c7ccccc7c7ccccc76)cccc54)ccc32)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ EDNRB P24530 1/20 0.33
▸ EDNRA P25101 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TSPO P30536 1/20 0.33
▸ RAC2 P15153 1/20 0.32
▸ RAC3 P60763 1/20 0.32
▸ CDC42 P60953 1/20 0.32
▸ RAC1 P63000 1/20 0.32
▸ HDAC4 P56524 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ IL1R1 P14778 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
SCHEMBL25010828 0.94 L3MBTL1 (0.46) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL19849209 0.94 L3MBTL1 (0.46) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL26049291 0.94 L3MBTL1 (0.46) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL19849113 0.93 ATM (0.45) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL19849112 0.93 ATM (0.45) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL19978808 0.93 L3MBTL1 (0.49) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL27050296 0.93 L3MBTL1 (0.49) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL20708415 0.92 ATM (0.44) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL27050294 0.92 L3MBTL1 (0.47) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL25789793 0.92 L3MBTL1 (0.47) KDM4EATML3MBTL1EDNRBEDNRA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023008501-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 日鉄ケミカル&マテリアル株式会社 2023-02-02 — — WO disclosed
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