SCHEMBL9829437

SCHEMBL9829437

CCNCc1cc(S(=O)(=O)c2ccc(S(N)(=O)=O)s2)ccc1O

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA2 P00918 18/20 0.67
CA1 P00915 8/20 0.43
POLB P06746 1/20 0.42
CA12 O43570 5/20 0.41
CA9 Q16790 5/20 0.41
LOX P28300 1/20 0.41

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
SCHEMBL9829489 0.87 CA2 (0.63) CA2CA1
SCHEMBL9828539 0.81 CA2 (0.77) CA2POLB
SCHEMBL9827904 0.81 CA2 (1.00) CA2POLBLOX
SCHEMBL9832127 0.81 CA2 (0.61) CA2CA1POLBCA12CA9
Hydrochloric Acid SCHEMBL29426319 0.80 CA2 (0.97) CA2POLBLOX
SCHEMBL137017 0.77 CA2 (0.45) CA2CA1POLBCA12CA9
Hydrochloric Acid SCHEMBL7572821 0.77 CA2 (0.77) CA2POLBLOX
SCHEMBL9829011 0.73 LOX (0.52) CA2CA1CA12CA9LOX
SCHEMBL12809039 0.72 POLB (0.56) CA2CA1POLBCA12CA9
SCHEMBL4901587 0.71 POLB (0.62) CA2POLB

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