SCHEMBL25934819

SCHEMBL25934819

Cc1c(CNC(=O)OC(C)(C)C)c(C)c(CNC(=O)OC(C)(C)C)c(CCCN=N)c1CNC(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.37
▸ MEN1 O00255 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GFER P55789 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ KDM4A O75164 1/20 0.34
▸ NR1H4 Q96RI1 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ GLS O94925 1/20 0.32
▸ KCNA5 P22460 1/20 0.32
▸ CA12 O43570 2/20 0.32
▸ CA1 P00915 2/20 0.32
▸ CA2 P00918 2/20 0.32
▸ CA9 Q16790 2/20 0.32
▸ NPSR1 Q6W5P4 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
SCHEMBL25952167 0.83 TDP1 (0.51) TDP1MEN1GAAKMT2AKDM4E
SCHEMBL22535987 0.82 TDP1 (0.46) TDP1MEN1GAAKMT2AKDM4E
SCHEMBL25934847 0.78 MAPK1 (0.38) TDP1MEN1GAAKMT2AKDM4E
SCHEMBL25934811 0.76 CA1 (0.37) TDP1MEN1GAAKMT2AKDM4E
SCHEMBL30662746 0.75 KDM4E (0.40) TDP1MEN1GAAKMT2AKDM4E
SCHEMBL891563 0.75 TDP1 (0.59) TDP1MEN1GAAKMT2AHTT
SCHEMBL20502594 0.71 KMT2A (0.39) TDP1MEN1GAAKMT2AKDM4E
SCHEMBL891230 0.71 TDP1 (0.53) TDP1MEN1GAAKMT2AGFER
SCHEMBL22535990 0.71 TDP1 (0.44) TDP1MEN1GAAKMT2AKDM4E
SCHEMBL30895753 0.67 POLB (0.43) TDP1MEN1GAAKMT2AKDM4E

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-2023144545-A1 SACCHARIDE SENSING SYSTEMS Carbometrics Limited (GB) 2023-08-03 — — WO disclosed
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