SCHEMBL3946161

SCHEMBL3946161

Cc1c(S(=O)(=O)O)sc2ccc(Br)cc12

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 8/20 0.53
PFKFB4 Q16877 7/20 0.53
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
EPM2A O95278 1/20 0.38
PTPN2 P17706 1/20 0.38
PTPN1 P18031 1/20 0.38
PTPN22 Q9Y2R2 1/20 0.38
CMA1 P23946 4/20 0.38
AKR1B1 P15121 1/20 0.38
BCL2 P10415 1/20 0.36
BCL2L1 Q07817 1/20 0.36

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
SCHEMBL1742182 0.85 PFKFB3 (0.51) PFKFB3PFKFB4NPSR1L3MBTL1EPM2A
SCHEMBL787935 0.84 PFKFB3 (0.50) PFKFB3PFKFB4NPSR1L3MBTL1EPM2A
SCHEMBL787942 0.81 CMA1 (0.51) PFKFB3PFKFB4NPSR1L3MBTL1CMA1
SCHEMBL2226181 0.81 NPSR1 (0.60) PFKFB3PFKFB4NPSR1L3MBTL1CMA1
Hydrochloric Acid SCHEMBL6712744 0.79 NPSR1 (0.59) PFKFB3PFKFB4NPSR1L3MBTL1CMA1
SCHEMBL787895 0.78 PFKFB3 (0.57) PFKFB3PFKFB4NPSR1L3MBTL1CMA1
SCHEMBL806148 0.78 L3MBTL1 (0.47) PFKFB3PFKFB4NPSR1L3MBTL1CMA1
SCHEMBL6027735 0.77 L3MBTL1 (0.39) PFKFB3PFKFB4NPSR1L3MBTL1CMA1
SCHEMBL788255 0.77 L3MBTL1 (0.46) PFKFB3PFKFB4NPSR1L3MBTL1CMA1
SCHEMBL3684890 0.77 MEN1 (0.43) PFKFB3PFKFB4NPSR1L3MBTL1CMA1

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-1450806-B1 USE OF SULFONAMIDE DERIVATIVES IN THE TREATMENT OF OBESITY OR FOR THE REDUCTION OF FOOD INTAKE BIOVITRUM AB PUBL (SE) 2009-04-29 EP disclosed
EP-1696915-A1 BENZENESULFONYLAMINO-PYRIDIN-2-YL DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 (11-BETA-HSD-1) FOR THE TREATMENT OF DIABETES AND OBESITY Pfizer, Inc. (US) 2006-09-06 EP disclosed
US-20050148631-A1 Amino heterocyclyl inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 AGOURON PHARMACEUTICALS, INC. 2005-07-07 US disclosed
WO-2005060963-A1 BENZENESULFONYLAMINO-PYRIDIN-2-YL DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 (11-BETA-HSD-1) FOR THE TREATMENT OF DIABETES AND OBESITY PFIZER INC. (US) 2005-07-07 WO disclosed
EP-1450806-A1 USE OF SULFONAMIDE DERIVATIVES IN THE TREATMENT OF OBESITY OR FOR THE REDUCTION OF FOOD INTAKE BIOVITRUM AB (SE) 2004-09-01 EP disclosed
US-20030166663-A1 Use BIOVITRUM AB (SE) 2003-09-04 US disclosed
WO-2003039547-A1 USE OF SULFONAMIDE DERIVATIVES IN THE TREATMENT OF OBESITY OR FOR THE REDUCTION OF FOOD INTAKE BIOVITRUM AB (SE) 2003-05-15 WO disclosed
EP-1228066-A2 SULFONAMIDE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2002-08-07 EP disclosed
WO-2001032646-A2 SULFONAMIDE DERIVATIVES SMITHKLINE BEECHAM P.L.C. (GB) 2001-05-10 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-20050148631-A1 Amino heterocyclyl inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD17B11, HSD11B2 PFKFB3 3931/4885PFKFB4 3867/4885NPSR1 1936/4885
US-20030166663-A1 Use SULT2A1, SULT1A1, SLC5A1 PFKFB3 2345/4885PFKFB4 2318/4885NPSR1 76/4885

“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.