SCHEMBL9828668

SCHEMBL9828668

CCCCNCc1ccc(S(=O)(=O)c2csc(S(N)(=O)=O)c2)cc1

nearest known ligand 0.98

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CA2 P00918 20/20 0.98

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
SCHEMBL9829292 0.83 CA2 (1.00) CA2
Hydrochloric Acid SCHEMBL9830371 0.82 CA2 (1.00) CA2
SCHEMBL9829659 0.76 CA2 (0.60) CA2
SCHEMBL9829759 0.75 CA2 (0.66) CA2
Hydrochloric Acid SCHEMBL9828498 0.74 CA2 (1.00) CA2
SCHEMBL17795624 0.72 HRH4 (0.56) CA2
SCHEMBL6927505 0.70 CA2 (0.71) CA2
SCHEMBL14064844 0.70 CA2 (0.67) CA2
SCHEMBL9829056 0.70 CA2 (1.00) CA2
Hydrochloric Acid SCHEMBL9827751 0.68 CA2 (1.00) CA2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0295049-B1 THIOPHENE SULFONAMIDE ANTIGLAUCOMA AGENTS MERCK & CO. INC. (US) 1991-10-09 EP disclosed
US-4847289-A Thiophene sulfonamide antiglaucoma agents MERCK & CO., INC. (US) 1989-07-11 US disclosed
EP-0295049-A2 Thiophene sulfonamide antiglaucoma agents MERCK & CO. INC. (US) 1988-12-14 EP disclosed