⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29895058 | 0.77 | — | — | |
| SCHEMBL28779173 | 0.72 | CA5A (0.39) | — | |
| SCHEMBL4582111 | 0.69 | — | — | |
| SCHEMBL9736289 | 0.69 | — | — | |
| SCHEMBL3080703 | 0.67 | — | — | |
| Sulfuric Acid SCHEMBL20560520 | 0.65 | — | — | |
| SCHEMBL133983 | 0.64 | TSHR (0.43) | — | |
| Sulfuric Acid SCHEMBL29861157 | 0.63 | — | — | |
| SCHEMBL29079969 | 0.61 | — | — | |
| SCHEMBL6890356 | 0.61 | CA5A (0.46) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240174534-A1 | RESPONSIVE PRODUCTION AND DELIVERY OF VARIABLE COMPOSITION AQUEOUS HALOGENS IN WATER TREATMENT APPLICATIONS | DE NORA HOLDINGS US, INC. | 2024-05-30 | — | — | US | disclosed |
| EP-4323312-A2 | RESPONSIVE PRODUCTION AND DELIVERY OF VARIABLE COMPOSITION AQUEOUS HALOGENS IN WATER TREATMENT APPLICATIONS | De Nora Holdings US, Inc. (US) | 2024-02-21 | — | — | EP | disclosed |
| WO-2022221406-A2 | RESPONSIVE PRODUCTION AND DELIVERY OF VARIABLE COMPOSITION AQUEOUS HALOGENS IN WATER TREATMENT APPLICATIONS | DE NORA HOLDINGS US, INC. (US) | 2022-10-20 | — | — | WO | disclosed |
| US-10172360-B2 | Methods for the direct electrolytic production of stable, high concentration aqueous halosulfamate or halosulfonamide solutions | JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) | 2019-01-08 | — | — | US | disclosed |
| WO-2016094591-A1 | METHODS FOR THE DIRECT ELECTROLYTIC PRODUCTION OF STABLE, HIGH CONCENTRATION AQUEOUS HALOSULFAMATE OR HALOSULFONAMIDE SOLUTIONS | MIOX CORPORATION (US) | 2016-06-16 | — | — | WO | disclosed |
| US-20160157494-A1 | Methods for the Direct Electrolytic Production of Stable, High Concentration Aqueous Halosulfamate or Halosulfonamide Solutions | DE NORA HOLDINGS US, INC. | 2016-06-09 | — | — | US | disclosed |