SCHEMBL3774458

SCHEMBL3774458

Nc1cccc(I)c1S(N)(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 15/20 0.45
CA1 P00915 14/20 0.45
CA9 Q16790 12/20 0.45
CA12 O43570 9/20 0.45
CA4 P22748 6/20 0.45
CA7 P43166 6/20 0.45
CA14 Q9ULX7 5/20 0.45
CA6 P23280 4/20 0.45
CA5A P35218 4/20 0.45
CA5B Q9Y2D0 4/20 0.45
CYP2C9 P11712 1/20 0.45
GAA P10253 1/20 0.37
CA13 Q8N1Q1 3/20 0.34
CA3 P07451 2/20 0.34
PLA2G7 Q13093 1/20 0.34
TTR P02766 1/20 0.34
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
USP2 O75604 1/20 0.33
AGO2 Q9UKV8 1/20 0.33

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
SCHEMBL10797668 0.81 TTR (0.46) CA2CA1CA9CA12CA4
SCHEMBL3776131 0.78 CDK2 (0.44) CA2CA1CA9CA12CA4
SCHEMBL13006837 0.77 ALDH1A1 (0.39) CA2CA1CA9CA12CA4
SCHEMBL3771716 0.77 CA1 (0.43) CA2CA1CA9CA12CA7
SCHEMBL9584262 0.76 ALOX15 (0.48) CA2CA1CA9CA12CA4
SCHEMBL5353941 0.76 TSHR (0.48) CA2CA1CA9CA12CA4
SCHEMBL5626712 0.76 CA2 (0.46) CA2CA1CA9CA12CA4
SCHEMBL2542148 0.76 CA2 (0.64) CA2CA1CA9CA12CA4
SCHEMBL3782946 0.74 CA1 (0.45) CA2CA1CA9CA12CA4
SCHEMBL1523492 0.74 CD44 (0.48) CA2CA1CA9CA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1717228-A1 Sulfonylamino(thio)carbonylderivatives as herbicides or plant growth regulators Bayer CropScience GmbH (DE) 2006-11-02 EP claimed
US-7855166-B2 Sulfonylamino(thio)carbonyl compounds BAYER CROPSCIENCE GMBH (DE) 2010-12-21 US disclosed
EP-1877380-A1 SULFONYLAMINO(THIO)CARBONYL COMPOUNDS IN THE FORM OF HERBICIDES OR PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2008-01-16 EP disclosed
US-20060258536-A1 Sulfonylamino(thio)carbonyl compounds BAYER CROPSCIENCE GMBH (DE) 2006-11-16 US disclosed
EP-1717228-A1 Sulfonylamino(thio)carbonylderivatives as herbicides or plant growth regulators Bayer CropScience GmbH (DE) 2006-11-02 EP disclosed
WO-2006114221-A1 SULFONYLAMINO(THIO)CARBONYL COMPOUNDS IN THE FORM OF HERBICIDES OR PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2006-11-02 WO disclosed
EP-0636124-A1 3,4-DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-1,1-DIOXIDE-3-CARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME Aventis Pharma S.A. (FR) 1995-02-01 EP disclosed
WO-1993021171-A1 USE OF 2H-1,2,4-BENZOTHIADIAZINE-1,1-DIOXIDE-3-CARBOXYLIC ACID DERIVATIVES FOR PREPARING NMDA/AMPA RECEPTOR ANTAGONIST DRUGS, NOVEL PRODUCTS, PREPARATION THEREOF AND DRUGS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1993-10-28 WO disclosed
WO-1993021170-A1 3,4-DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-1,1-DIOXIDE-3-CARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1993-10-28 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-20060258536-A1 Sulfonylamino(thio)carbonyl compounds TST, CBR3, MYB CA2 3775/4885CA1 4582/4885CA9 3837/4885

“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.