⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL82321 | 0.94 | — | — | |
| SCHEMBL7414350 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL27717534 | 0.89 | — | — | |
| Hydrogen Sulfide SCHEMBL28022286 | 0.89 | — | — | |
| SCHEMBL834114 | 0.89 | — | — | |
| SCHEMBL28348968 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL27662755 | 0.89 | — | — | |
| Water SCHEMBL27996335 | 0.89 | TSHR (0.31) | — | |
| SCHEMBL30093000 | 0.89 | — | — | |
| SCHEMBL2126733 | 0.80 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110804006-B | Ethylicin original medicine with low impurity content, preparation method and application thereof | 海南正业中农高科股份有限公司 | 2022-08-05 | — | — | CN | disclosed |
| CN-110804006-A | Ethylicin original medicine with low impurity content, preparation method and application thereof | 海南正业中农高科股份有限公司 | 2020-02-18 | — | — | CN | disclosed |