SCHEMBL7525017

SCHEMBL7525017

NC1CCCCC1(N)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.34
F2 P00734 2/20 0.31
PRSS1 P07477 2/20 0.31
PRSS2 P07478 2/20 0.31
PRSS3 P35030 2/20 0.31
CA1 P00915 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL7529372 0.82
SCHEMBL28053508 0.72 CA1 (0.32) CA2CA1
SCHEMBL2949828 0.60 GAA (0.51)
SCHEMBL7527601 0.60 CA2 (0.42) CA2CA1MMP1MMP2MMP9
SCHEMBL19042350 0.59 CA1 (0.48) CA2CA1MMP1MMP2MMP9
SCHEMBL11338159 0.58 CA1 (0.47) CA2CA1MMP1MMP2MMP9
SCHEMBL27868365 0.57 CA2 (0.42) CA2F2PRSS1PRSS2PRSS3
SCHEMBL1978683 0.57
Sulfuric Acid SCHEMBL11494938 0.57
SCHEMBL22169227 0.56

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-1185488-A1 SULPHONYLAMIDES AND CARBOXAMIDES AND THEIR USE IN ASYMMETRICAL CATALYSIS RHODIA CHIMIE (FR) 2002-03-13 EP claimed
WO-2000076942-A1 SULPHONYLAMIDES AND CARBOXAMIDES AND THEIR USE IN ASYMMETRICAL CATALYSIS RHODIA CHIMIE (FR) 2000-12-21 WO claimed
EP-1185488-A1 SULPHONYLAMIDES AND CARBOXAMIDES AND THEIR USE IN ASYMMETRICAL CATALYSIS RHODIA CHIMIE (FR) 2002-03-13 EP disclosed
WO-2000076942-A1 SULPHONYLAMIDES AND CARBOXAMIDES AND THEIR USE IN ASYMMETRICAL CATALYSIS RHODIA CHIMIE (FR) 2000-12-21 WO disclosed