⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL412591 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL28873011 | 0.89 | — | — | |
| SCHEMBL29140240 | 0.89 | — | — | |
| Ethylene Glycol SCHEMBL2776460 | 0.77 | — | — | |
| SCHEMBL624854 | 0.68 | — | — | |
| SCHEMBL1358446 | 0.68 | — | — | |
| Carbonotrithioic Acid SCHEMBL27903774 | 0.68 | CA1 (1.00) | — | |
| Carbonotrithioic Acid SCHEMBL5146473 | 0.68 | — | — | |
| SCHEMBL31115 | 0.68 | — | — | |
| Carbonotrithioic Acid SCHEMBL19959 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0514177-B1 | Catalyst for treating wastewater, process for producing it, and process for trating wastewater with the catalyst | NIPPON CATALYTIC CHEM IND (JP) | 1998-09-09 | — | — | EP | disclosed |
| US-5620610-A | MIXED OXIDE CATALYST OPTIONALLY CONTAINING A METAL OR COMPOUND OF A METAL | NIPPON SHOKUBAI CO., LTD. (JP) | 1997-04-15 | — | — | US | disclosed |
| US-5399541-A | By wet oxidation, iron oxide calcined with metal oxides | NIPPON SHOKUBAI CO., LTD. (JP) | 1995-03-21 | — | — | US | disclosed |
| US-5374599-A | Catalyst for treating wastewater, process for producing it, and process for treating wastewater with the catalyst | NIPPON SHOKUBAI CO., LTD. (JP) | 1994-12-20 | — | — | US | disclosed |
| EP-0514177-A1 | Catalyst for treating wastewater, process for producing it, and process for trating wastewater with the catalyst | NIPPON SHOKUBAI CO., LTD. (JP) | 1992-11-19 | — | — | EP | disclosed |