⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3774244 | 0.84 | — | — | |
| SCHEMBL424313 | 0.80 | — | — | |
| SCHEMBL5944552 | 0.80 | — | — | |
| SCHEMBL372904 | 0.77 | — | — | |
| SCHEMBL422555 | 0.74 | — | — | |
| Fluoride SCHEMBL1898729 | 0.72 | — | — | |
| Bromide SCHEMBL2121618 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL557288 | 0.72 | — | — | |
| Iodide SCHEMBL1758303 | 0.72 | — | — | |
| Bromide SCHEMBL557590 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112480385-B | Method for preparing polycarbonate by using binuclear ionic liquid as catalyst | 中国科学院过程工程研究所 | 2021-11-30 | — | — | CN | disclosed |
| CN-112480385-A | Method for preparing polycarbonate by using binuclear ionic liquid as catalyst | 中国科学院过程工程研究所 | 2021-03-12 | — | — | CN | disclosed |