⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL860465 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL15875941 | 0.98 | — | — | |
| SCHEMBL574892 | 0.86 | — | — | |
| SCHEMBL13130776 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL1703551 | 0.84 | POLB (0.33) | — | |
| SCHEMBL18556058 | 0.70 | POLB (0.33) | — | |
| SCHEMBL931732 | 0.67 | — | — | |
| SCHEMBL1326171 | 0.65 | — | — | |
| Acetic Acid SCHEMBL4904825 | 0.64 | — | — | |
| SCHEMBL17867453 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210289794-A1 | COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE | FLAGSHIP PIONEERING INNOVATIONS V, INC. | 2021-09-23 | — | — | US | disclosed |
| CN-111424060-A | Biological method for simultaneously preparing D-proline and L-1-pyrroline-5-carboxylic acid | 重庆邮电大学 | 2020-07-17 | — | — | CN | disclosed |