⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28929335 | 1.00 | — | — | |
| SCHEMBL20913028 | 1.00 | — | — | |
| SCHEMBL8068005 | 0.76 | — | — | |
| SCHEMBL10686260 | 0.76 | — | — | |
| SCHEMBL10686269 | 0.76 | — | — | |
| SCHEMBL28929333 | 0.76 | — | — | |
| SCHEMBL7675583 | 0.71 | ALDH1A1 (0.39) | — | |
| SCHEMBL3189718 | 0.69 | — | — | |
| SCHEMBL20930481 | 0.67 | HCAR2 (0.46) | — | |
| SCHEMBL21589352 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3473098-A1 | COMPOSITION FOR REGULATING PLANT GROWTH, METHOD FOR TREATING PLANTS THEREWITH, AND ACTIVE INGREDIENT THEREOF | Gorbunov, Sergei Valeryevich (RU) | 2019-04-24 | — | — | EP | disclosed |