⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9360 | 0.90 | — | — | |
| SCHEMBL9362 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL277848 | 0.87 | — | — | |
| Water SCHEMBL5487305 | 0.87 | — | — | |
| SCHEMBL4149569 | 0.87 | — | — | |
| SCHEMBL1965919 | 0.87 | — | — | |
| Hydroxyamine SCHEMBL17187300 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL7039746 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL3433151 | 0.84 | TSHR (0.38) | — | |
| Sulfuric Acid SCHEMBL1415592 | 0.82 | TSHR (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4665229-A | Preparation of hydroxy alkyl amide thio ether compounds from bicyclic amide acetal and thiol | ASHLAND OIL, INC. (US) | 1987-05-12 | — | — | US | claimed |
| US-4766201-A | Hydroxy alkyl amide thio ether composition from bis-bicyclic amide acetal and polythiol | ASHLAND OIL INC. (US) | 1988-08-23 | — | — | US | disclosed |
| US-4766201-A | Hydroxy alkyl amide thio ether composition from bis-bicyclic amide acetal and polythiol | ASHLAND OIL INC. (US) | 1988-08-23 | — | — | US | disclosed |
| US-4766201-A | Hydroxy alkyl amide thio ether composition from bis-bicyclic amide acetal and polythiol | ASHLAND OIL INC. (US) | 1988-08-23 | — | — | US | disclosed |
| US-4665229-A | Preparation of hydroxy alkyl amide thio ether compounds from bicyclic amide acetal and thiol | ASHLAND OIL, INC. (US) | 1987-05-12 | — | — | US | disclosed |
| US-4665229-A | Preparation of hydroxy alkyl amide thio ether compounds from bicyclic amide acetal and thiol | ASHLAND OIL, INC. (US) | 1987-05-12 | — | — | US | disclosed |
| US-4665229-A | Preparation of hydroxy alkyl amide thio ether compounds from bicyclic amide acetal and thiol | ASHLAND OIL, INC. (US) | 1987-05-12 | — | — | US | disclosed |