SCHEMBL8982139

SCHEMBL8982139

C=CC(=O)ONS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 16/20 0.49
CA1 P00915 15/20 0.49
MMP1 P03956 6/20 0.49
MMP2 P08253 6/20 0.49
MMP9 P14780 6/20 0.49
MMP8 P22894 6/20 0.49
MMP13 P45452 6/20 0.49
F2 P00734 4/20 0.36
PRSS1 P07477 4/20 0.36
PRSS2 P07478 4/20 0.36
PRSS3 P35030 4/20 0.36

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
SCHEMBL28429940 1.00 CA2 (0.49) CA2CA1MMP1MMP2MMP9
SCHEMBL740188 0.98 CA2 (0.47) CA2CA1MMP1MMP2MMP9
SCHEMBL11787529 0.80 CA2 (0.45) CA2CA1MMP1MMP2MMP9
SCHEMBL19725179 0.79 CA1 (0.38) CA2CA1
SCHEMBL28389265 0.78 CA2 (0.53) CA2CA1MMP1MMP2MMP9
SCHEMBL5399542 0.77 CA2 (0.45) CA2CA1MMP1MMP2MMP9
SCHEMBL8982151 0.76 CA2 (0.47) CA2CA1MMP1MMP2MMP9
SCHEMBL9070226 0.76 CA2 (0.44) CA2CA1MMP1MMP2MMP9
SCHEMBL3646279 0.76 CA2 (0.44) CA2CA1MMP1MMP2MMP9
SCHEMBL3188419 0.75 CA2 (0.43) CA2CA1MMP1MMP2MMP9

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-0448883-B1 Combination comprising a release liner sheet. MINNESOTA MINING & MFG (US) 1996-05-29 EP disclosed