SCHEMBL13633938

SCHEMBL13633938

CCS(=O)(=O)NS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 18/20 0.52
CA1 P00915 17/20 0.52
MMP1 P03956 6/20 0.52
MMP2 P08253 6/20 0.52
MMP9 P14780 6/20 0.52
MMP8 P22894 6/20 0.52
MMP13 P45452 6/20 0.52
F2 P00734 2/20 0.37
PRSS1 P07477 2/20 0.37
PRSS2 P07478 2/20 0.37
PRSS3 P35030 2/20 0.37

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
SCHEMBL16813975 0.82 CA2 (0.47) CA2CA1MMP1MMP2MMP9
SCHEMBL899196 0.82 CA2 (0.65) CA2CA1MMP1MMP2MMP9
SCHEMBL108003 0.81 CA2 (0.46) CA2CA1MMP1MMP2MMP9
Hydrogen Sulfide SCHEMBL30884173 0.80 CA2 (0.62) CA2CA1MMP1MMP2MMP9
SCHEMBL20476642 0.80 CA2 (0.62) CA2CA1MMP1MMP2MMP9
SCHEMBL3435260 0.80 CA2 (0.62) CA2CA1MMP1MMP2MMP9
Potassium SCHEMBL30087547 0.80 CA2 (0.62) CA2CA1MMP1MMP2MMP9
SCHEMBL7797690 0.80 CA2 (0.67) CA2CA1MMP1MMP2MMP9
SCHEMBL20473121 0.80 CA2 (0.67) CA2CA1MMP1MMP2MMP9
SCHEMBL898868 0.80 CA2 (0.67) 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
WO-2013065878-A1 METHOD OF FORMING PATTERN AND COMPOSITION FOR CROSSLINKED LAYER FORMATION TO BE USED IN THE METHOD FUJIFILM CORPORATION (JP) 2013-05-10 WO disclosed