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Sugi Predict / Compounds / SCHEMBL25565083

SCHEMBL25565083

SCHEMBL25565083

N#Cc1ccc2c(c1)C1c3cc(C#N)ccc3C2c2c(-c3ccc4c(c3)c3ccccc3n4-c3cccc(-c4ccccc4)c3)cccc21

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ PTGER4 P35408 1/20 0.31
▸ PRKDC P78527 1/20 0.31
▸ ADRA2C P18825 1/20 0.31
▸ AKT1 P31749 1/20 0.30
▸ IRAK4 Q9NWZ3 1/20 0.30
▸ CFD P00746 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
SCHEMBL25565145 0.88 KDM4E (0.35) KDM4EATML3MBTL1PTGER4IRAK4
SCHEMBL25565141 0.87 KDM4E (0.35) KDM4EATML3MBTL1PTGER4AKT1
SCHEMBL25119403 0.83 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL25119436 0.83 L3MBTL1 (0.43) KDM4EATML3MBTL1PTGER4
SCHEMBL18767552 0.82 ATM (0.44) KDM4EATML3MBTL1PTGER4IRAK4
SCHEMBL17034400 0.82 ATM (0.44) KDM4EATML3MBTL1PTGER4IRAK4
SCHEMBL25119358 0.82 AKT1 (0.36) KDM4EATML3MBTL1AKT1
SCHEMBL17032725 0.81 ATM (0.46) KDM4EATML3MBTL1PTGER4IRAK4
SCHEMBL18792456 0.81 ATM (0.46) KDM4EATML3MBTL1PTGER4IRAK4
SCHEMBL17032732 0.81 ATM (0.46) KDM4EATML3MBTL1PTGER4IRAK4

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-2023094412-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-06-01 — — WO disclosed