SCHEMBL6728408

SCHEMBL6728408

CC(C)C(=O)C[S+]1CCOCC1.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.33
CA2 P00918 5/20 0.33
MMP1 P03956 5/20 0.33
MMP2 P08253 5/20 0.33
MMP9 P14780 5/20 0.33
MMP8 P22894 5/20 0.33
MMP13 P45452 5/20 0.33

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
SCHEMBL6727489 0.99 CA1 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL6551529 0.88 CA1 (0.35) CA1CA2MMP1MMP2MMP9
SCHEMBL6728304 0.87 CA1 (0.31) CA1CA2MMP1MMP2MMP9
SCHEMBL6727660 0.87 CA1 (0.31) CA1CA2MMP1MMP2MMP9
SCHEMBL6550587 0.87 CA2 (0.35) CA1CA2MMP1MMP2MMP9
SCHEMBL6550874 0.87 CA1 (0.34) CA1CA2MMP1MMP2MMP9
SCHEMBL6727858 0.87 CA1 (0.33) CA1CA2MMP1MMP2MMP9
Trifluoromethanesulfonic Acid SCHEMBL6735572 0.86
SCHEMBL6731889 0.86 CA1 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL6726202 0.86 CA1 (0.33) CA1CA2MMP1MMP2MMP9

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-20040224251-A1 Positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-11 US disclosed