⚠ 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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL367828 | 0.76 | — | — | |
| Ethylene Glycol SCHEMBL27601023 | 0.76 | — | — | |
| SCHEMBL6952085 | 0.74 | — | — | |
| SCHEMBL33248 | 0.74 | — | — | |
| Ethylene Glycol SCHEMBL3197361 | 0.73 | TSHR (0.46) | — | |
| Ethylene Glycol SCHEMBL3200076 | 0.73 | TSHR (0.46) | — | |
| Ethylene Glycol SCHEMBL168612 | 0.73 | — | — | |
| Ethylene Glycol SCHEMBL10715768 | 0.73 | — | — | |
| Ethylene Glycol SCHEMBL622577 | 0.73 | TSHR (0.46) | — | |
| Ethylene Glycol SCHEMBL9133774 | 0.73 | TSHR (0.46) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114522505-A | Direct air carbon dioxide capture system based on amine-loaded solid adsorbent | 上海交通大学 | 2022-05-24 | — | — | CN | disclosed |
| EP-0819758-B1 | Cationic vehicle: DNA complexes and their use in gene therapy | MIXSON ARCHIBALD JAMES (US) | 2006-09-20 | — | — | EP | disclosed |
| EP-0819758-A2 | Cationic vehicle: DNA complexes and their use in gene therapy | Mixson, Archibald James (US) | 1998-01-21 | — | — | EP | disclosed |