⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9054523 | 0.94 | — | — | |
| Sulfuric Acid SCHEMBL434526 | 0.72 | CA5A (1.00) | — | |
| Sulfuric Acid SCHEMBL418399 | 0.72 | CA5A (1.00) | — | |
| Sulfuric Acid SCHEMBL562154 | 0.72 | CA5A (1.00) | — | |
| Sulfuric Acid SCHEMBL2555505 | 0.72 | CA5A (1.00) | — | |
| Sulfuric Acid SCHEMBL113 | 0.72 | — | — | |
| Sulfuric Acid SCHEMBL110268 | 0.72 | CA5A (1.00) | — | |
| Sulfuric Acid SCHEMBL3699224 | 0.72 | CA5A (1.00) | — | |
| Sulfuric Acid SCHEMBL8532128 | 0.72 | CA5A (1.00) | — | |
| Sulfuric Acid SCHEMBL23440697 | 0.67 | CA5A (0.86) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115806639-A | Polymerization method of nickel-based cis-butadiene and application thereof | 中国石油化工股份有限公司 | 2023-03-17 | — | — | CN | claimed |
| CN-118255918-A | Process for the preparation of polybutadiene | 中国石油天然气股份有限公司 | 2024-06-28 | — | — | CN | disclosed |
| CN-115806639-A | Polymerization method of nickel-based cis-butadiene and application thereof | 中国石油化工股份有限公司 | 2023-03-17 | — | — | CN | disclosed |
| WO-1996000698-A1 | RARE EARTH RECOVERY PROCESS | PURE ETCH CO. (US) | 1996-01-11 | — | — | WO | disclosed |
| US-5429724-A | Neodymium recovery process | PURE-ETCH CO. (US) | 1995-07-04 | — | — | US | disclosed |
| WO-1994026665-A1 | NEODYMIUM RECOVERY PROCESS | PURE-ETCH CO. (US) | 1994-11-24 | — | — | WO | disclosed |
| US-5362459-A | Neodymium recovery process | PURE-ETCH CO. (US) | 1994-11-08 | — | — | US | disclosed |