⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1964874 | 0.70 | ALDH1A1 (0.34) | — | |
| SCHEMBL4918741 | 0.70 | GAA (0.30) | — | |
| SCHEMBL513789 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL4915206 | 0.69 | GAA (0.31) | — | |
| SCHEMBL515113 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL514096 | 0.67 | CMA1 (0.37) | — | |
| SCHEMBL1967282 | 0.66 | KMT2A (0.39) | — | |
| SCHEMBL514316 | 0.66 | ALDH1A1 (0.34) | — | |
| SCHEMBL16862452 | 0.65 | KDM4E (0.34) | — | |
| SCHEMBL1967062 | 0.65 | MAPT (0.33) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8048825-B2 | Haloalkylsulfonanilide derivatives or salt thereof, herbicide comprising the derivatives as active ingredient, and use of the herbicide | NIHON NOHYAKU CO., LTD. (JP) | 2011-11-01 | — | — | US | disclosed |
| US-20100016164-A1 | HALOALKYLSULFONANILIDE DERIVATIVES OR SALT THEREOF, HERBICIDE COMPRISING THE DERIVATIVES AS ACTIVE INGREDIENT, AND USE OF THE HERBICIDE | NIHON NOHYAKU CO., LTD. (JP) | 2010-01-21 | — | — | US | disclosed |
| EP-2085392-A1 | HALOALKYLSULFONANILIDE DERIVATIVE OR SALT THEREOF, HERBICIDE COMPRISING THE DERIVATIVE AS ACTIVE INGREDIENT, AND USE OF THE HERBICIDE | Nihon Nohyaku CO., LTD. (JP) | 2009-08-05 | — | — | EP | disclosed |