⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3012130 | 0.92 | — | — | |
| Bromide SCHEMBL3006965 | 0.90 | — | — | |
| Iodide SCHEMBL3014010 | 0.90 | — | — | |
| Water SCHEMBL28967095 | 0.90 | — | — | |
| SCHEMBL3015776 | 0.88 | — | — | |
| SCHEMBL28982060 | 0.85 | — | — | |
| SCHEMBL28516723 | 0.84 | — | — | |
| SCHEMBL28982055 | 0.84 | — | — | |
| Phosphoric Acid SCHEMBL3014411 | 0.81 | FDPS (0.33) | — | |
| Sulfuric Acid SCHEMBL17273280 | 0.81 | — | — |
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-110479037-B | Composite absorbent and method for separating and purifying ethylene oxide by using same | 中国科学院过程工程研究所 | 2021-04-27 | — | — | CN | disclosed |