SCHEMBL5311444

SCHEMBL5311444

NS(=O)(=O)c1ccc(C=Nc2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 13/20 1.00
▸ PTGS1 P23219 7/20 1.00
▸ CA2 P00918 12/20 0.87
▸ CA9 Q16790 11/20 0.87
▸ CA1 P00915 11/20 0.87
▸ CA12 O43570 7/20 0.87
▸ CA7 P43166 4/20 0.83

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
SCHEMBL5311443 1.00 PTGS2 (1.00) PTGS2PTGS1CA2CA9CA1
SCHEMBL5310957 0.93 PTGS2 (1.00) PTGS2PTGS1CA2CA9CA1
SCHEMBL1517598 0.93 PTGS2 (1.00) PTGS2PTGS1CA2CA9CA1
SCHEMBL5309673 0.83 PTGS2 (1.00) PTGS2PTGS1CA2CA9CA1
SCHEMBL5314091 0.83 CA2 (1.00) PTGS2PTGS1CA2CA9CA1
SCHEMBL5312743 0.83 PTGS2 (1.00) PTGS2PTGS1CA2CA9CA1
SCHEMBL5311687 0.83 PTGS2 (1.00) PTGS2PTGS1CA2CA9CA1
SCHEMBL5314088 0.83 CA2 (1.00) PTGS2PTGS1CA2CA9CA1
SCHEMBL5312741 0.83 PTGS2 (1.00) PTGS2PTGS1CA2CA9CA1
SCHEMBL18719842 0.83 CA2 (1.00) PTGS2PTGS1CA2CA9CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150011749-A1 USE OF CERTAIN METAL-ACCUMULATING PLANTS FOR THE PERFORMANCE OF ORGANIC CHEMISTRY REACTIONS UNIVERSITE MONTPELLIER 2 SCIENCES ET TECHNIQUES (FR) 2015-01-08 — — US disclosed
EP-0799823-B1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses DAIICHI SANKYO CO LTD (JP) 2007-10-31 — — EP disclosed
EP-0799823-A1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1997-10-08 — — 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-20150011749-A1 USE OF CERTAIN METAL-ACCUMULATING PLANTS FOR THE PERFORMANCE OF ORGANIC CHEMISTRY REACTIONS ME1, OSGEP, AGL PTGS2 1588/4885PTGS1 1899/4885CA2 811/4885

“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.

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