⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8996630 | 0.78 | PABPC1 (0.34) | — | |
| SCHEMBL9521322 | 0.76 | — | — | |
| SCHEMBL13399394 | 0.75 | PABPC1 (0.38) | — | |
| SCHEMBL13381186 | 0.75 | PABPC1 (0.35) | — | |
| SCHEMBL13399152 | 0.75 | PABPC1 (0.35) | — | |
| SCHEMBL13381180 | 0.75 | PABPC1 (0.38) | — | |
| SCHEMBL13381181 | 0.73 | PABPC1 (0.41) | — | |
| SCHEMBL13399311 | 0.73 | PABPC1 (0.41) | — | |
| SCHEMBL14272697 | 0.72 | GAA (0.33) | — | |
| SCHEMBL13381179 | 0.72 | GAA (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0355597-B1 | SUBSTITUTED DIOXOLANYLETHYLAMINES, PROCESS FOR THEIR PREPARATION, THEIR USE IN PESTICIDES, AND INTERMEDIATES | BAYER AG (DE) | 1993-06-09 | — | — | EP | disclosed |
| EP-0355597-A1 | Substituted dioxolanylethylamines, process for their preparation, their use in pesticides, and intermediates | BAYER AG (DE) | 1990-02-28 | — | — | EP | disclosed |