⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29080972 | 0.89 | — | — | |
| SCHEMBL28391841 | 0.89 | — | — | |
| SCHEMBL593121 | 0.89 | — | — | |
| SCHEMBL2730131 | 0.80 | — | — | |
| SCHEMBL16670957 | 0.80 | — | — | |
| SCHEMBL5891778 | 0.80 | — | — | |
| SCHEMBL28703026 | 0.80 | — | — | |
| SCHEMBL36464 | 0.78 | — | — | |
| SCHEMBL15992494 | 0.73 | — | — | |
| SCHEMBL492830 | 0.67 | — | — |
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-113426440-B | Pretreatment method and application of catalyst for cyclic carbonate synthesis | 中国科学院山西煤炭化学研究所 | 2023-01-20 | — | — | CN | disclosed |
| CN-113426440-A | Pretreatment method and application of catalyst for cyclic carbonate synthesis | 中国科学院山西煤炭化学研究所 | 2021-09-24 | — | — | CN | disclosed |