⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL373166 | 0.67 | HSP90AA1 (0.50) | — | |
| SCHEMBL580735 | 0.65 | HSP90AA1 (0.40) | — | |
| Hydrochloric Acid SCHEMBL4760945 | 0.64 | HSP90AA1 (0.47) | — | |
| SCHEMBL9302157 | 0.61 | — | — | |
| SCHEMBL540171 | 0.61 | — | — | |
| SCHEMBL2320499 | 0.61 | — | — | |
| SCHEMBL185512 | 0.61 | — | — | |
| SCHEMBL8777290 | 0.61 | — | — | |
| SCHEMBL5163976 | 0.61 | — | — | |
| SCHEMBL8823020 | 0.61 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9096551-B2 | Method for producing 2-(triazinylcarbonyl) sulfonanilides | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-08-04 | — | — | US | disclosed |
| US-20140024828-A1 | Method for producing 2-(triazinylcarbonyl) sulfonanilides | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2014-01-23 | — | — | US | disclosed |
| EP-2655346-A2 | METHOD FOR PRODUCING 2-(TRIAZINYLCARBONYL) SULFONANILIDES | Bayer Intellectual Property GmbH (DE) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012084857-A2 | METHOD FOR PRODUCING 2-(TRIAZINYLCARBONYL) SULFONANILIDES | BAYER CROPSCIENCE AG (DE) | 2012-06-28 | — | — | WO | disclosed |
| EP-0127446-A1 | Esters of 2-bromo-4-methylimidazole-5-carboxylic acid | STAUFFER CHEMICAL COMPANY (US) | 1984-12-05 | — | — | EP | disclosed |