SCHEMBL8183649

SCHEMBL8183649

CCCCOc1ccc(S(=O)(=O)C(C)C(N)=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.58
CA1 P00915 3/20 0.58
CA2 P00918 3/20 0.58
CA9 Q16790 3/20 0.58
CA7 P43166 2/20 0.58
TSHR P16473 2/20 0.58
MMP3 P08254 3/20 0.49
MMP1 P03956 3/20 0.49
MMP13 P45452 3/20 0.49
MMP2 P08253 2/20 0.49
MMP14 P50281 2/20 0.49
ADAMTS4 O75173 1/20 0.49
ADAMTS5 Q9UNA0 1/20 0.49
MMP9 P14780 2/20 0.48
MMP8 P22894 2/20 0.48
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46

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
SCHEMBL6932207 0.84 CA12 (0.53) CA12CA1CA2CA9CA7
SCHEMBL14478146 0.81 TSHR (0.64) CA12CA1CA2CA9CA7
SCHEMBL17795418 0.78 TSHR (0.60) CA12CA1CA2CA9CA7
SCHEMBL7372085 0.77 CA12 (0.55) CA12CA1CA2CA9CA7
SCHEMBL8861382 0.77 CA12 (0.55) CA12CA1CA2CA9CA7
SCHEMBL930267 0.77 CA12 (0.72) CA12CA1CA2CA9CA7
SCHEMBL11764911 0.76 CA12 (0.62) CA12CA1CA2CA9CA7
SCHEMBL16540402 0.76 MMP13 (0.55) CA1CA2MMP3MMP1MMP13
SCHEMBL8189066 0.76 SOS1 (0.53) CA12CA1CA2CA9MMP3
SCHEMBL13588816 0.74 CA12 (0.64) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1037868-A2 $g(a)-HYDROXY, -AMINO, AND HALO DERIVATIVES OF $g(b)-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2000-09-27 EP claimed
WO-1999026909-A2 ALPHA-HYDROXY, -AMINO AND -FLUORO DERIVATIVES OF BETA-SULPHONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1999-06-03 WO claimed
EP-1037868-A2 $g(a)-HYDROXY, -AMINO, AND HALO DERIVATIVES OF $g(b)-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2000-09-27 EP disclosed
WO-1999026909-A2 ALPHA-HYDROXY, -AMINO AND -FLUORO DERIVATIVES OF BETA-SULPHONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1999-06-03 WO disclosed