SCHEMBL25934811

SCHEMBL25934811

Cc1c(CNC(=O)OC(C)(C)C)c(C)c(CNC(=O)OC(C)(C)C)c(CCCOS(C)(=O)=O)c1CNC(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 12/20 0.37
▸ CA2 P00918 12/20 0.37
▸ CA12 O43570 9/20 0.37
▸ CA9 Q16790 9/20 0.37
▸ TDP1 Q9NUW8 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HTT P42858 1/20 0.33
▸ KDM4A O75164 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
SCHEMBL25952167 0.81 TDP1 (0.51) CA1CA2CA12CA9TDP1
SCHEMBL22535987 0.80 TDP1 (0.46) CA1CA2CA12CA9TDP1
SCHEMBL25934819 0.76 TDP1 (0.37) CA1CA2CA12CA9TDP1
SCHEMBL455207 0.76 TDP1 (0.56) CA1CA2CA12CA9TDP1
SCHEMBL25934847 0.76 MAPK1 (0.38) CA2CA12TDP1KDM4ELMNA
SCHEMBL691118 0.75 TDP1 (0.58) CA1CA2CA12CA9TDP1
SCHEMBL23833687 0.74 TDP1 (0.61) CA1CA2CA12CA9TDP1
SCHEMBL5056320 0.74 TDP1 (0.61) CA1CA2CA12CA9TDP1
SCHEMBL21997325 0.74 TDP1 (0.61) CA1CA2CA12CA9TDP1
SCHEMBL7527124 0.74 TDP1 (0.61) CA1CA2CA12CA9TDP1

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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