SCHEMBL10371815

SCHEMBL10371815

CN(C)CCOc1ccc2sc(S(N)(=O)=O)cc2c1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 18/20 0.63
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL10372421 0.84 CA2 (0.70) CA2
SCHEMBL10369130 0.83 CA2 (0.63) CA2
Hydrochloric Acid SCHEMBL10371505 0.83 CA2 (0.63) CA2
SCHEMBL3483161 0.83 CA2 (0.63) CA2
SCHEMBL10373186 0.80 CA2 (0.68) CA2KDM4EALDH1A1
SCHEMBL3483644 0.79 KDM4E (0.42) CA2KDM4EALDH1A1
SCHEMBL13032409 0.78 KDM4E (0.50) KDM4EALDH1A1
SCHEMBL2087596 0.78 CA2 (1.00) CA2
SCHEMBL10369727 0.77 CA2 (0.75) CA2
SCHEMBL10369623 0.76 CA2 (0.81) CA2ALDH1A1

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-0129478-B1 2-SULFAMOYLBENZO (B) THIOPHENE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF ELEVATED INTRAOCULAR PRESSURE MERCK & CO. INC. (US) 1990-01-17 EP disclosed
US-4788192-A TOPICALLY APPLYING; FOR GLAUCOMA MERCK & CO., INC. (US) 1988-11-29 US disclosed
US-4668697-A Elevated intraocular pressure lowering benzo-[b]-thiophene-2-sulfonamide derivatives, compositions, and method of use therefor MERCK & CO., INC. (US) 1987-05-26 US disclosed
EP-0129478-A2 2-Sulfamoylbenzo (b) thiophene derivatives, their preparation and pharmaceutical composition for the treatment of elevated intraocular pressure MERCK & CO. INC. (US) 1984-12-27 EP disclosed