⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2816106 | 1.00 | — | — | |
| SCHEMBL291057 | 0.87 | EP300 (0.34) | — | |
| SCHEMBL291059 | 0.87 | EP300 (0.34) | — | |
| Hydrogen Sulfide SCHEMBL465804 | 0.86 | EP300 (0.33) | — | |
| SCHEMBL290896 | 0.84 | TBXAS1 (0.35) | — | |
| SCHEMBL111604 | 0.84 | TBXAS1 (0.35) | — | |
| Alcohol SCHEMBL28078437 | 0.83 | EP300 (0.33) | — | |
| SCHEMBL1425197 | 0.83 | TBXAS1 (0.34) | — | |
| SCHEMBL1425200 | 0.83 | TBXAS1 (0.34) | — | |
| Hydrogen Sulfide SCHEMBL379592 | 0.83 | TBXAS1 (0.34) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8808786-B2 | Medicinal inhalation devices and components thereof | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2014-08-19 | — | — | US | disclosed |
| US-20130213395-A1 | MEDICINAL INHALATION DEVICES AND COMPONENTS THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2013-08-22 | — | — | US | disclosed |
| US-8430097-B2 | Medicinal inhalation devices and components thereof | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2013-04-30 | — | — | US | disclosed |
| US-8414956-B2 | Medicinal inhalation devices and components thereof | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2013-04-09 | — | — | US | disclosed |
| US-20100247932-A1 | MEDICINAL INHALATION DEVICES AND COMPONENTS THEREOF | 3M INNOVATIVE PROPERTIES COMPANY | 2010-09-30 | — | — | US | disclosed |
| US-20100242958-A1 | MEDICINAL INHALATION DEVICES AND COMPONENTS THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2010-09-30 | — | — | US | disclosed |
| EP-2205303-A2 | MEDICINAL INHALATION DEVICES AND COMPONENTS THEREOF | 3M Innovative Properties Company (US) | 2010-07-14 | — | — | EP | disclosed |
| EP-2205302-A2 | MEDICINAL INHALATION DEVICES AND COMPONENTS THEREOF | 3M Innovative Properties Company (US) | 2010-07-14 | — | — | EP | disclosed |
| WO-2009061895-A2 | MEDICINAL INHALATION DEVICES AND COMPONENTS THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-05-14 | — | — | WO | disclosed |
| WO-2009061891-A2 | MEDICINAL INHALATION DEVICES AND COMPONENTS THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-05-14 | — | — | WO | disclosed |