SCHEMBL10896764

SCHEMBL10896764

CCCS(=O)(=O)C(=Cc1cccc([N+](=O)[O-])c1)C(C)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 2/20 0.61
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ CA4 P22748 1/20 0.53
▸ CA7 P43166 1/20 0.53
▸ ALDH1A1 P00352 10/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ LMNA P02545 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ FBP1 P09467 1/20 0.49
▸ NPSR1 Q6W5P4 3/20 0.47
▸ USP2 O75604 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ XBP1 P17861 1/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ HTT P42858 3/20 0.46
▸ GAA P10253 1/20 0.46
▸ MAPT P10636 3/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ TRPM8 Q7Z2W7 1/20 0.44

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
SCHEMBL10896757 1.00 GLO1 (0.61) GLO1CA1CA2CA4CA7
SCHEMBL10983993 0.91 GLO1 (0.66) GLO1CA1CA2CA4CA7
SCHEMBL10983080 0.83 GLO1 (0.59) GLO1CA1CA2CA4CA7
SCHEMBL10988257 0.81 GLO1 (0.51) GLO1CA1CA2CA4CA7
SCHEMBL11564904 0.79 GLO1 (0.63) GLO1CA1CA2CA4CA7
SCHEMBL10989985 0.78 GLO1 (0.61) GLO1CA1CA2CA4CA7
SCHEMBL8028846 0.77 GLO1 (1.00) GLO1CA1CA2CA4CA7
SCHEMBL9866499 0.76 GLO1 (0.59) GLO1CA1CA2CA4CA7
SCHEMBL9866504 0.76 GLO1 (0.59) GLO1CA1CA2CA4CA7
SCHEMBL10982646 0.76 GLO1 (0.59) GLO1CA1CA2CA4CA7

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
JP-61293972-A — — None — — JP disclosed
JP-S61293972-A 1,4-DIHYDROXYPYRIDINESULFONE DERIVATIVE AND PRODUCTION THEREOF NISSHIN FLOUR MILLING CO LTD 1986-12-24 — — JP disclosed
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