SCHEMBL9682117

SCHEMBL9682117

COC(C)OC(C)N(CCC1CNc2cc(S(N)(=O)=O)sc2S1(=O)=O)C(C)OC

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 20/20 0.65
CA4 P22748 1/20 0.35
CA1 P00915 1/20 0.34

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
Hydrochloric Acid SCHEMBL9683925 0.99 CA2 (0.64) CA2CA4CA1
SCHEMBL9682085 0.83 CA2 (0.61) CA2CA4CA1
SCHEMBL7531741 0.79 CA2 (1.00) CA2CA4CA1
Hydrochloric Acid SCHEMBL9683140 0.78 CA2 (0.98) CA2CA4CA1
SCHEMBL9682123 0.75 CA2 (1.00) CA2CA4
SCHEMBL7522817 0.75 CA2 (1.00) CA2
Hydrochloric Acid SCHEMBL9683928 0.74 CA2 (0.98) CA2CA4
SCHEMBL7532953 0.74 CA2 (1.00) CA2
Hydrochloric Acid SCHEMBL9683782 0.73 CA2 (0.98) CA2
SCHEMBL7525189 0.71 CA2 (1.00) CA2CA4

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-0479480-A2 Substituted thieno(2,3-B)(1,4)thiazine-6-sulfonamides as antiglaucoma agents MERCK & CO. INC. (US) 1992-04-08 EP claimed
US-5093332-A SUBSTITUTED THIENO(2,3-B)(1,4)THIAZINE-6-SULFONAMIDES AS ANTIGLAUCOMA AGENTS MERCK & CO., INC. (US) 1992-03-03 US claimed
EP-0479480-A2 Substituted thieno(2,3-B)(1,4)thiazine-6-sulfonamides as antiglaucoma agents MERCK & CO. INC. (US) 1992-04-08 EP disclosed
US-5093332-A SUBSTITUTED THIENO(2,3-B)(1,4)THIAZINE-6-SULFONAMIDES AS ANTIGLAUCOMA AGENTS MERCK & CO., INC. (US) 1992-03-03 US disclosed