SCHEMBL3408263

SCHEMBL3408263

NS(=O)(=O)c1cccc(NC(=S)Nc2ccccc2I)c1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 12/20 0.59
CA2 P00918 12/20 0.59
CA9 Q16790 10/20 0.59
CA12 O43570 5/20 0.59
ALDH1A1 P00352 2/20 0.58
PKM P14618 1/20 0.58
MAPT P10636 1/20 0.55
PTPN7 P35236 1/20 0.54
PLK1 P53350 1/20 0.52

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
SCHEMBL3412568 0.85 PTPN7 (0.70) CA1CA2CA9CA12ALDH1A1
SCHEMBL7616638 0.84 CA1 (0.74) CA1CA2CA9CA12ALDH1A1
SCHEMBL3410287 0.82 CA1 (0.77) CA1CA2CA9CA12ALDH1A1
SCHEMBL3410038 0.80 CA1 (0.60) CA1CA2CA9CA12ALDH1A1
SCHEMBL18955311 0.79 CA1 (0.64) CA1CA2CA9CA12ALDH1A1
SCHEMBL4522845 0.75 CA1 (0.64) CA1CA2CA9CA12ALDH1A1
SCHEMBL16771334 0.74 CA1 (0.62) CA1CA2CA9CA12ALDH1A1
SCHEMBL3410565 0.74 CA1 (1.00) CA1CA2CA9CA12ALDH1A1
SCHEMBL3409455 0.73 CA1 (0.68) CA1CA2CA9CA12ALDH1A1
SCHEMBL1395590 0.71 CA1 (1.00) CA1CA2CA9CA12MAPT

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
EP-2823826-A2 Inhibitors of carbonic anhydrase IX Molecular Insight Pharmaceuticals, Inc. (US) 2015-01-14 EP disclosed
EP-2823826-A2 Inhibitors of carbonic anhydrase IX Molecular Insight Pharmaceuticals, Inc. (US) 2015-01-14 EP disclosed
US-8877970-B2 Inhibitors of carbonic anhydrase IX MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2014-11-04 US disclosed
US-8877970-B2 Inhibitors of carbonic anhydrase IX MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2014-11-04 US disclosed
US-8877970-B2 Inhibitors of carbonic anhydrase IX MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2014-11-04 US disclosed
EP-2240171-A2 INHIBITORS OF CARBONIC ANHYDRASE IX Molecular Insight Pharmaceuticals, Inc. (US) 2010-10-20 EP disclosed
WO-2009089383-A2 INHIBITORS OF CARBONIC ANHYDRASE IX MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2009-07-16 WO disclosed
WO-2009089383-A2 INHIBITORS OF CARBONIC ANHYDRASE IX MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2009-07-16 WO disclosed
US-20090175794-A1 INHIBITORS OF CARBONIC ANHYDRASE IX MOLECULAR INSIGHT PHARMACEUTICALS, INC. 2009-07-09 US disclosed
US-20090175794-A1 INHIBITORS OF CARBONIC ANHYDRASE IX MOLECULAR INSIGHT PHARMACEUTICALS, INC. 2009-07-09 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-20090175794-A1 INHIBITORS OF CARBONIC ANHYDRASE IX CA9, CA12, CA1 CA1 3/4885CA2 7/4885CA9 1/4885

“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.