SCHEMBL14726220

SCHEMBL14726220

NS(=O)(=O)Nc1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.79
CA2 P00918 3/20 0.79
CA12 O43570 2/20 0.79
CA9 Q16790 2/20 0.79
CA5A P35218 1/20 0.79
CA5B Q9Y2D0 1/20 0.79
MEN1 O00255 8/20 0.71
KMT2A Q03164 8/20 0.71
MAPT P10636 6/20 0.71
HTT P42858 5/20 0.71
POLB P06746 3/20 0.71
DDX3X O00571 2/20 0.71
CTDSP1 Q9GZU7 1/20 0.71
GAA P10253 2/20 0.66
BAZ1A Q9NRL2 3/20 0.63
IDH1 O75874 1/20 0.59
TP53 P04637 1/20 0.59
CASP3 P42574 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
SENP7 Q9BQF6 1/20 0.59

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
SCHEMBL672979 0.88 CA2 (1.00) CA1CA2CA12CA9CA5A
SCHEMBL1047211 0.84 MEN1 (1.00) CA1CA2CA12CA9CA5A
SCHEMBL12111855 0.84 CA12 (0.70) CA1CA2CA12CA9CA5A
SCHEMBL1311061 0.83 MEN1 (0.79) CA1CA2CA12CA9CA5A
SCHEMBL6129390 0.83 MEN1 (0.90) CA1CA2CA12CA9CA5A
SCHEMBL17084065 0.83 MEN1 (0.96) CA1CA2CA12CA9CA5A
SCHEMBL673171 0.83 CA2 (1.00) CA1CA2CA12CA9CA5A
Ammonia Solution, Strong SCHEMBL20268307 0.82 MEN1 (0.77) CA1CA2CA12CA9CA5A
SCHEMBL12112907 0.82 CA12 (0.67) CA1CA2CA12CA9CA5A
SCHEMBL22092552 0.81 MEN1 (0.79) CA1CA2CA12CA9CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130053392-A1 CARBONIC ANHYDRASE INHIBITORS UNIVERSITETET I OSLO (NO) 2013-02-28 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-20130053392-A1 CARBONIC ANHYDRASE INHIBITORS CA9, CA2, CA4 CA1 5/4885CA2 2/4885CA12 8/4885

“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.