SCHEMBL2899528

SCHEMBL2899528

CC[C@@H](CC(F)(F)F)[C@@H](CO)NS(=O)(=O)c1sc2ccc(Cl)cc2c1C

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CMA1 P23946 7/20 0.47
PFKFB3 Q16875 7/20 0.46
PFKFB4 Q16877 7/20 0.46
HTR6 P50406 3/20 0.40

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
SCHEMBL5669992 1.00 NPSR1 (0.48) NPSR1L3MBTL1CMA1PFKFB3PFKFB4
SCHEMBL5669995 1.00 NPSR1 (0.48) NPSR1L3MBTL1CMA1PFKFB3PFKFB4
SCHEMBL13508287 0.81 NPSR1 (0.56) NPSR1L3MBTL1CMA1PFKFB3PFKFB4
SCHEMBL13508316 0.79 NPSR1 (0.60) NPSR1L3MBTL1CMA1PFKFB3PFKFB4
SCHEMBL5669997 0.78 NPSR1 (0.41) NPSR1L3MBTL1CMA1PFKFB3PFKFB4
SCHEMBL2899531 0.78 NPSR1 (0.41) NPSR1L3MBTL1CMA1PFKFB3PFKFB4
SCHEMBL2888157 0.76 PSEN1 (0.68) HTR6
SCHEMBL2888245 0.76 PSEN1 (0.68) HTR6
SCHEMBL2888247 0.76 PSEN1 (0.68) HTR6
SCHEMBL2888161 0.76 PSEN1 (0.68) HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227667-A1 FLUORO- AND TRIFLUOROALKYL-CONTAINING HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION AND DERIVATIVES THEREOF WYETH (US) 2009-09-10 US claimed
US-7547725-B2 Fluoro- and trifluoroalkyl-containing heterocyclic sulfonamide inhibitors of beta amyloid production and derivatives thereof WYETH (US) 2009-06-16 US claimed
US-20070254929-A1 Fluoro-and trifluoroalkyl-containing heterocyclic sulfonamide inhibitors of beta amyloid production and derivatives thereof WYETH (US) 2007-11-01 US claimed
US-7858658-B2 Fluoro- and trifluoroalkyl-containing heterocyclic sulfonamide inhibitors of beta amyloid production and derivatives thereof WYETH LLC (US) 2010-12-28 US disclosed
US-20090227667-A1 FLUORO- AND TRIFLUOROALKYL-CONTAINING HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION AND DERIVATIVES THEREOF WYETH (US) 2009-09-10 US disclosed
US-7547725-B2 Fluoro- and trifluoroalkyl-containing heterocyclic sulfonamide inhibitors of beta amyloid production and derivatives thereof WYETH (US) 2009-06-16 US disclosed
US-20070254929-A1 Fluoro-and trifluoroalkyl-containing heterocyclic sulfonamide inhibitors of beta amyloid production and derivatives thereof WYETH (US) 2007-11-01 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 (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-20070254929-A1 Fluoro-and trifluoroalkyl-containing heterocyclic sulfonamide inhibitors of beta amyloid production and derivatives thereof SCN8A, CHD8, CHRNA7 NPSR1 46/4885L3MBTL1 1180/4885CMA1 2373/4885
US-20090227667-A1 FLUORO- AND TRIFLUOROALKYL-CONTAINING HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION AND DERIVATIVES THEREOF SCN8A, CHD8, CDR2 NPSR1 47/4885L3MBTL1 1199/4885CMA1 2244/4885

“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.