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SCHEMBL6730765

SCHEMBL6730765

CC(C)(C)C(=O)C[S+]1CCC(=O)CC1.O=S(=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 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ MMP1 P03956 1/20 0.32
▸ MMP2 P08253 1/20 0.32
▸ MMP9 P14780 1/20 0.32
▸ MMP8 P22894 1/20 0.32
▸ MMP13 P45452 1/20 0.32

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
SCHEMBL6726173 0.99 CA1 (0.30) CA1CA2MMP1MMP2MMP9
SCHEMBL6723156 0.88 CA1 (0.32) CA1CA2MMP1MMP2MMP9
SCHEMBL6728100 0.88 CA1 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL4491532 0.87 CA2 (0.35) CA1CA2MMP1MMP2MMP9
SCHEMBL6732199 0.86 MMP1 (0.32) CA1CA2MMP1MMP2MMP9
SCHEMBL6727874 0.86 CA1 (0.32) CA1CA2MMP1MMP2MMP9
SCHEMBL6551515 0.86 CA1 (0.34) CA1CA2MMP1MMP2MMP9
SCHEMBL2919744 0.86 CA1 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL4492549 0.86 CA1 (0.33) CA1CA2MMP1MMP2MMP9
Trifluoromethanesulfonic Acid SCHEMBL6726238 0.86 — —

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 2 patents. 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
US-6548220-B2 Containing acid generator SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-04-15 — — US disclosed