⚠ 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 SCHEMBL19127955 | 1.00 | — | — | |
| Ethylene Glycol SCHEMBL5860524 | 0.89 | TSHR (0.50) | — | |
| Trichloroethane SCHEMBL27782599 | 0.85 | — | — | |
| Carbon Tetrachloride SCHEMBL29044091 | 0.82 | — | — | |
| Ethylene Glycol SCHEMBL2780045 | 0.82 | — | — | |
| Ethylene Glycol SCHEMBL28043287 | 0.80 | — | — | |
| Ethylene Glycol SCHEMBL27763258 | 0.80 | TSHR (0.71) | — | |
| Ethylene Glycol SCHEMBL125371 | 0.80 | — | — | |
| Ethylene Glycol SCHEMBL28065939 | 0.80 | — | — | |
| Ethylene Glycol SCHEMBL10902002 | 0.80 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108586794-B | Immune adsorbent for rheumatoid factor for blood perfusion and preparation method thereof | 南开大学 | 2020-11-10 | — | — | CN | disclosed |