SCHEMBL7520641

SCHEMBL7520641

COC(C)OC(C)N(C(=O)CC1C(=O)Nc2cc(S(N)(=O)=O)sc2S1(=O)=O)C(C)OC

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 20/20 0.62
CA1 P00915 5/20 0.35
CA4 P22748 4/20 0.32

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
SCHEMBL9682085 0.84 CA2 (0.61) CA2CA1CA4
SCHEMBL9683786 0.78 CA2 (0.61) CA2CA1
SCHEMBL9682131 0.78 CA2 (0.61) CA2CA1CA4
SCHEMBL7520645 0.77 CA2 (1.00) CA2CA4
SCHEMBL9682638 0.75 CA2 (0.58) CA2CA1CA4
SCHEMBL9683840 0.74 CA2 (0.47) CA2CA1CA4
SCHEMBL9683128 0.72 CA2 (0.55) CA2CA1CA4
SCHEMBL9683134 0.71 CA2 (0.51) CA2CA1CA4
SCHEMBL9682117 0.69 CA2 (0.65) CA2CA1CA4
Hydrochloric Acid SCHEMBL9683925 0.69 CA2 (0.64) CA2CA1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020094981-A1 Ophthalmic compositions for treating ocular hypertension MERCK & CO., INC. 2002-07-18 US claimed
EP-0998277-A1 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION Merck & Co., Inc. (a New Jersey corp.) (US) 2000-05-10 EP claimed
WO-1998053809-A1 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 1998-12-03 WO 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 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
US-20020094981-A1 Ophthalmic compositions for treating ocular hypertension MERCK & CO., INC. 2002-07-18 US disclosed
EP-0998277-A1 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION Merck & Co., Inc. (a New Jersey corp.) (US) 2000-05-10 EP disclosed
WO-1998053809-A1 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 1998-12-03 WO disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020094981-A1 Ophthalmic compositions for treating ocular hypertension PTGIS, CA2, PTGS1 CA2 2/4885CA1 111/4885CA4 9/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.