⚠ 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 | |
|---|---|---|---|---|
| Ethylamine SCHEMBL976987 | 0.65 | — | — | |
| SCHEMBL6436737 | 0.64 | — | — | |
| SCHEMBL13463930 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL11470445 | 0.60 | — | — | |
| SCHEMBL204690 | 0.57 | — | — | |
| SCHEMBL254201 | 0.55 | MEN1 (0.38) | — | |
| SCHEMBL109023 | 0.55 | — | — | |
| SCHEMBL203882 | 0.55 | MEN1 (0.38) | — | |
| SCHEMBL201927 | 0.53 | — | — | |
| SCHEMBL9611219 | 0.50 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019197454-A1 | BARRIER LAYERS AND COMPOSITIONS FOR PRODUCING SAME | Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) | 2019-10-17 | — | — | WO | disclosed |
| EP-1678267-B1 | COMPOSITION FOR PRODUCING A BARRIER LAYER FOR GASES | EVONIK DEGUSSA GMBH (DE) | 2011-12-21 | — | — | EP | disclosed |
| US-20070099004-A1 | Composition for producing a barrier layer for gases | DEGUSSA AG (DE) | 2007-05-03 | — | — | US | disclosed |
| EP-1678267-A1 | COMPOSITION FOR PRODUCING A BARRIER LAYER FOR GASES | Degussa AG (DE) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005040294-A1 | COMPOSITION FOR PRODUCING A BARRIER LAYER FOR GASES | DEGUSSA AG (DE) | 2005-05-06 | — | — | WO | disclosed |