SCHEMBL3480221

SCHEMBL3480221

Nc1ccc2sc(S(=O)(=O)NCP(=O)(O)O)cc2c1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.41
TPSAB1 Q15661 1/20 0.36
CHRNA7 P36544 1/20 0.34
FBP1 P09467 1/20 0.33
HDAC1 Q13547 1/20 0.33
CLK1 P49759 1/20 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
SCHEMBL3480316 0.82 HDAC1 (0.38) CA2TPSAB1FBP1HDAC1
SCHEMBL14931228 0.81 CA2 (0.46) CA2TPSAB1HDAC1
SCHEMBL3483343 0.78 HDAC1 (0.40) CA2FBP1HDAC1
SCHEMBL3483371 0.77 CA2 (0.38) CA2FBP1HDAC1CLK1
SCHEMBL3483790 0.77 CA2 (0.38) CA2TPSAB1FBP1HDAC1CLK1
SCHEMBL3483211 0.77 CA2 (0.38) CA2FBP1HDAC1
SCHEMBL3483169 0.77 LIMK2 (0.35) CA2TPSAB1HDAC1
SCHEMBL13031977 0.76 TRPV4 (0.36)
SCHEMBL3480329 0.75 TOP1 (0.47) CA2HDAC1
SCHEMBL3483644 0.75 KDM4E (0.42) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049200-B1 NOVEL INHIBITORS OF BETA-LACTAMASE METHYLGENE INC (CA) 2015-04-29 EP disclosed
US-8440643-B2 Inhibitors of beta-lactamase METHYLGENE INC. (CA) 2013-05-14 US disclosed
US-20100317625-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE 92229129 QUEBEC INC. (CA) 2010-12-16 US disclosed
US-20100279983-A1 NOVEL INHIBITORS OF BETA-LACTAMASE METHYLGENE INC. 2010-11-04 US disclosed
EP-2049200-A2 NOVEL INHIBITORS OF BETA-LACTAMASE MethylGene Inc. (CA) 2009-04-22 EP disclosed
WO-2008073142-A2 NOVEL INHIBITORS OF BETA-LACTAMASE MERCK & CO., INC. (US) 2008-06-19 WO 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 (2 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-20100317625-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE MGAM, BPGM, PPME1 CA2 2070/4885TPSAB1 466/4885CHRNA7 4673/4885
US-20100279983-A1 NOVEL INHIBITORS OF BETA-LACTAMASE MGAM, MGAM2, PGLS CA2 440/4885TPSAB1 171/4885CHRNA7 3401/4885

“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.