⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1521422 | 0.59 | — | — | |
| SCHEMBL30902355 | 0.58 | — | — | |
| SCHEMBL4450913 | 0.57 | — | — | |
| SCHEMBL7537150 | 0.52 | — | — | |
| SCHEMBL15908513 | 0.52 | — | — | |
| SCHEMBL4357719 | 0.49 | — | — | |
| SCHEMBL25365303 | 0.49 | NPC1 (0.40) | — | |
| SCHEMBL5961448 | 0.48 | — | — | |
| SCHEMBL1521444 | 0.48 | — | — | |
| SCHEMBL1450032 | 0.48 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116444498-A | THR beta receptor agonist compound, preparation method and application thereof | 拓臻股份有限公司 | 2023-07-18 | — | — | CN | disclosed |
| CN-113194958-B | THR beta receptor agonist compound, preparation method and application thereof | 拓臻股份有限公司 | 2023-05-23 | — | — | CN | disclosed |
| US-7005492-B2 | Copolymer rubber, and foamed article, vulcanized rubber, profile extrusion molded rubber and hose for water comprising said copolymer rubber | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2006-02-28 | — | — | US | disclosed |
| US-20040106760-A1 | Copolymer rubber, and foamed article, vulcanized rubber, profile extrusion molded rubber and hose for water comprising said copolymer rubber | SUMITOMO CHEMICAL COMPANY, LIMITED | 2004-06-03 | — | — | US | disclosed |
| EP-0358103-A1 | Method for the preparation of a polymer | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1990-03-14 | — | — | EP | disclosed |
| US-4387257-A | BICYCLIC DIOLEFIN ANTIKNOCK ADDITIVE | PHILLIPS PETROLEUM COMPANY (US) | 1983-06-07 | — | — | US | disclosed |