SCHEMBL9853410

SCHEMBL9853410

CCCOc1ccc(S(=O)(=O)c2ccccc2O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.58
CA1 P00915 5/20 0.58
CA2 P00918 5/20 0.58
CA9 Q16790 5/20 0.58
CA7 P43166 4/20 0.58
TSHR P16473 3/20 0.50
MMP2 P08253 4/20 0.46
MMP12 P39900 3/20 0.46
MMP13 P45452 3/20 0.46
MMP14 P50281 3/20 0.46
MMP9 P14780 2/20 0.46
MMP1 P03956 1/20 0.46
MMP3 P08254 1/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LTA4H P09960 1/20 0.45
MMP8 P22894 2/20 0.44
MMP16 P51512 2/20 0.44
ABCC9 O60706 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
SCHEMBL1794276 0.91 MMP2 (0.50) CA12CA1CA2CA9CA7
SCHEMBL6364901 0.90 TSHR (0.54) CA12CA1CA2CA9CA7
SCHEMBL1791608 0.89 MMP2 (0.49) CA12CA1CA2CA9CA7
SCHEMBL1793050 0.89 MMP2 (0.49) CA12CA1CA2CA9CA7
SCHEMBL50959 0.88 MMP2 (0.48) CA12CA1CA2CA9CA7
SCHEMBL1793533 0.88 CA12 (0.49) CA12CA1CA2CA9CA7
SCHEMBL1794370 0.88 CA12 (0.49) CA12CA1CA2CA9CA7
SCHEMBL1792643 0.87 MMP2 (0.47) CA12CA1CA2CA9CA7
SCHEMBL10181500 0.85 MMP2 (0.49) CA12CA1CA2CA9CA7
SCHEMBL1793545 0.84 ALDH1A1 (0.45) CA12CA1CA2CA9CA7

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-0410721-A2 Heat-sensitive recording material NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1991-01-30 EP disclosed