SCHEMBL3379933

SCHEMBL3379933

NS(=O)(=O)Oc1ccc(Br)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA2 P00918 15/20 1.00
CA9 Q16790 15/20 1.00
CA1 P00915 14/20 1.00
CA12 O43570 1/20 0.68
STS P08842 5/20 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
SCHEMBL4665386 0.94 CA2 (0.88) CA2CA9CA1CA12STS
SCHEMBL6801137 0.79 CA1 (0.76) CA2CA9CA1CA12STS
SCHEMBL4976876 0.78 CA2 (0.80) CA2CA9CA1STS
SCHEMBL9451266 0.76 CA2 (0.76) CA2CA9CA1CA12STS
SCHEMBL2236572 0.76 CA2 (1.00) CA2CA9CA1CA12STS
SCHEMBL9788649 0.76 CA2 (0.61) CA2CA9CA1CA12
SCHEMBL4609033 0.76 CA2 (0.61) CA2CA9CA1CA12
SCHEMBL14015362 0.76 CA2 (0.61) CA2CA9CA1CA12STS
SCHEMBL9451347 0.76 CA2 (1.00) CA2CA9CA1CA12STS
SCHEMBL9451471 0.76 CA2 (1.00) CA2CA9CA1STS

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
WO-2023242845-A1 SULFAMATE BASED COVALENT LIGAND-DIRECTED RELEASE (CoLDR) COMPOUNDS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-12-21 WO disclosed
US-20230406837-A1 SULFAMATE MODULATORS OF PIN1 ACTIVITY AND USES THEREOF YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2023-12-21 US disclosed
WO-2010017405-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PAIN HELLER ADAM (US) 2010-02-11 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 (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-20230406837-A1 SULFAMATE MODULATORS OF PIN1 ACTIVITY AND USES THEREOF PIN1, PSTPIP2, PIN4 CA2 1952/4885CA9 3791/4885CA1 765/4885

“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.