SCHEMBL9523352

SCHEMBL9523352

COC(C)OCOC1CC(C)Sc2cc(S(N)(=O)=O)sc21

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 10/20 0.33
CA1 P00915 2/20 0.30
CA12 O43570 1/20 0.30
CA3 P07451 1/20 0.30
AR P10275 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA5A P35218 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
CA13 Q8N1Q1 1/20 0.30
CA14 Q9ULX7 1/20 0.30
CA5B Q9Y2D0 1/20 0.30
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL9523347 0.81 CA2 (0.38) CA2CA4
SCHEMBL9522023 0.75
SCHEMBL8792373 0.72 CA2 (0.33) CA2CA1CA12CA3AR
SCHEMBL8793885 0.72 CA2 (0.36) CA2CA1CA12CA4CA6
SCHEMBL8794508 0.70 CA2 (0.31) CA2
SCHEMBL8792558 0.70 CA2 (0.33) CA2CA1CA12CA4CA6
SCHEMBL8794608 0.70 CA2 (0.41) CA2CA1CA12CA4CA6
SCHEMBL8791615 0.70 CA2 (0.33) CA2CA1CA12CA3AR
SCHEMBL8794517 0.69 CA2 (0.46) CA2CA1CA12CA3AR
SCHEMBL8792744 0.69 CA2 (0.41) CA2CA1CA12CA3AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0296879-B1 SUBSTITUTED AROMATIC SULFONAMIDES AS ANTIGLAUCOMA AGENTS MERCK & CO. INC. (US) 1993-03-17 EP disclosed
US-4863922-A Substituted aromatic sulfonamides as antiglaucoma agents, compositions and use MERCK & CO., INC. (US) 1989-09-05 US disclosed
US-4824968-A REMOVING HYDROXYL GROUP WITH SODIUM IODIDE AND DICHLORODIMETHYLSILANE IN ACETONITRILE MERCK & CO., INC. (US) 1989-04-25 US disclosed
US-4820848-A Substituted aromatic sulfonamides as antiglaucoma agents MERCK & CO., INC. (US) 1989-04-11 US disclosed
US-4797413-A Thieno thiopyran sulfonamide derivatives, pharmaceutical compositions and use MERCK & CO., INC. (US) 1989-01-10 US disclosed
EP-0296879-A1 Substituted aromatic sulfonamides as antiglaucoma agents MERCK & CO. INC. (US) 1988-12-28 EP disclosed