⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28238716 | 0.74 | — | — | |
| SCHEMBL10524387 | 0.71 | — | — | |
| SCHEMBL7780990 | 0.71 | — | — | |
| SCHEMBL10524391 | 0.71 | — | — | |
| SCHEMBL27282 | 0.71 | — | — | |
| SCHEMBL7780988 | 0.71 | — | — | |
| SCHEMBL10718734 | 0.71 | — | — | |
| SCHEMBL15338800 | 0.71 | — | — | |
| SCHEMBL27283 | 0.71 | — | — | |
| SCHEMBL7827428 | 0.69 | TSHR (0.30) | — |
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-112369325-A | Safe, low-toxicity and high-efficiency sterilization method for plant explants | 甘肃亚盛农业研究院有限公司 | 2021-02-19 | — | — | CN | disclosed |