SCHEMBL6086512

SCHEMBL6086512

CCC(=O)N(CC)[C@@H]1C[C@@H](C)S(=O)(=O)c2sccc21

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.51
CA1 P00915 12/20 0.51
CA4 P22748 7/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.31
CA12 O43570 1/20 0.31
CA3 P07451 1/20 0.31
AR P10275 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
GAA P10253 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
SCHEMBL6086009 0.91 CA2 (0.52) CA2CA1CA4PTGDR2CA12
SCHEMBL6085263 0.89 CA2 (0.47) CA2CA1CA4PTGDR2CA12
SCHEMBL6086258 0.89 CA2 (0.47) CA2CA1CA4PTGDR2CA12
SCHEMBL18651236 0.86 CA2 (0.44) CA2CA1CA4PTGDR2CA12
SCHEMBL6086219 0.84 CA1 (0.49) CA2CA1CA4PTGDR2LMNA
SCHEMBL20068799 0.75 CA2 (0.86) CA2CA1CA4CA12CA3
SCHEMBL6087727 0.75 CA2 (0.86) CA2CA1CA4CA12CA3
SCHEMBL4329539 0.71 CA2 (0.35) CA2CA1CA4CA12CA3
SCHEMBL12315840 0.71 CA2 (0.35) CA2CA1CA4CA12CA3
SCHEMBL3346701 0.71 CA2 (0.35) CA2CA1CA4CA12CA3

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
US-7030250-B2 Process for obtaining 4-(N-alkylamino)-5,6-dihydro-4H-thien-(2,3-b)-thiopyran-2-sulfonamide-7,7-dioxides and intermediates RAGATIVES, S.L. (ES) 2006-04-18 US disclosed
EP-1329453-B1 METHOD FOR OBTAINING 4-(N-ALKYLAMINE)-5, 6-DIHYDRO-4H-THIENO-(2,3-B)-THIOPYRAN-2-SULFONAMIDE-7, 7-DIOXIDES AND INTERMEDIATE PRODUCTS RAGACTIVES SL (ES) 2004-06-16 EP disclosed
US-20030220509-A1 Process for obtaining 4-(N-alkylamino)-5,6-dihydro-4H-thien-(2,3-b)-thiopyran-2-sulfonamide-7,7-dioxides and intermediates RAGACTIVES, S.L. 2003-11-27 US disclosed
EP-1329453-A1 METHOD FOR OBTAINING 4-(N-ALKYLAMINE)-5, 6-DIHYDRO-4H-THIENO-(2,3-B)-THIOPYRAN-2-SULFAMIDE-7, 7-DIOXIDES AND INTERMEDIATE PRODUCTS Ragactives, S.L. (ES) 2003-07-23 EP 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-20030220509-A1 Process for obtaining 4-(N-alkylamino)-5,6-dihydro-4H-thien-(2,3-b)-thiopyran-2-sulfonamide-7,7-dioxides and intermediates CA7, CA2, CA4 CA2 2/4885CA1 24/4885CA4 3/4885

“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.