SCHEMBL20051699

SCHEMBL20051699

CC(C)CC(C)(C)OOS(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.36
MMP8 P22894 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
SCHEMBL4533276 0.78 MMP8 (0.32) MMP8
SCHEMBL297420 0.74 MMP8 (0.30) MMP8
SCHEMBL21061214 0.68 MMP8 (0.34) MMP8
SCHEMBL19178773 0.67 MMP8 (0.33) MMP8
SCHEMBL14606576 0.66 MMP8 (0.31) MMP8
SCHEMBL2296347 0.65 MMP8 (0.33) CA2MMP8
SCHEMBL19178774 0.65 MMP8 (0.33) MMP8
SCHEMBL22333722 0.65
SCHEMBL7774229 0.64
SCHEMBL609954 0.64 MMP8 (0.37) CA2MMP8

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
US-20180100123-A1 CLEANING SOLUTION KVI LLC 2018-04-12 US disclosed