SCHEMBL9412345

SCHEMBL9412345

Cc1ccc(S(=O)(=O)S(=O)(=O)C(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.52
▸ CA2 P00918 4/20 0.48
▸ CA1 P00915 3/20 0.48
▸ CA12 O43570 2/20 0.48
▸ CA9 Q16790 2/20 0.48
▸ CA3 P07451 1/20 0.48
▸ CA6 P23280 1/20 0.48
▸ CA5A P35218 1/20 0.48
▸ CA7 P43166 1/20 0.48
▸ CA5B Q9Y2D0 1/20 0.48
▸ GBA1 P04062 1/20 0.47
▸ TLR9 Q9NR96 1/20 0.46
▸ ALDH1A1 P00352 5/20 0.46
▸ TSHR P16473 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ MMP2 P08253 2/20 0.43
▸ MMP1 P03956 1/20 0.43
▸ MMP9 P14780 1/20 0.43
▸ MMP8 P22894 1/20 0.43
▸ MMP13 P45452 1/20 0.43

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
SCHEMBL5907770 0.80 GAA (0.50) GAACA2CA1CA12CA9
SCHEMBL547554 0.80 GAA (0.68) GAACA2CA1CA12CA9
SCHEMBL8038985 0.80 GAA (0.68) GAACA2CA1CA12CA9
SCHEMBL9412354 0.79 HTR6 (0.46) CA2CA1CA12CA9CA3
SCHEMBL9412352 0.77 PKM (0.57) GAACA2CA1CA12CA9
SCHEMBL178444 0.76 GAA (0.56) GAACA2CA1CA12CA9
SCHEMBL1060443 0.75 GAA (0.62) GAACA2CA1CA12CA9
SCHEMBL28449841 0.75 GAA (0.62) GAACA2CA1CA12CA9
SCHEMBL664115 0.73 GAA (0.59) GAACA2CA1CA12CA9
SCHEMBL1332797 0.73 GAA (0.59) GAACA2CA1CA12CA9

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
EP-0588544-A2 Fine pattern forming material and pattern formation process WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1994-03-23 — — EP disclosed
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