⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28207168 | 0.94 | SLC6A3 (0.33) | — | |
| SCHEMBL1526974 | 0.89 | — | — | |
| SCHEMBL28207744 | 0.78 | SLC6A3 (0.32) | — | |
| SCHEMBL7908819 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL41476 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL5046890 | 0.76 | — | — | |
| SCHEMBL13398917 | 0.76 | — | — | |
| SCHEMBL3817504 | 0.75 | — | — | |
| SCHEMBL2301166 | 0.74 | — | — | |
| SCHEMBL2301161 | 0.74 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5120849-A | Reacting cyclic imidoether with aminoalcohol | BASF AKTIENGESELLSCHAFT (DE) | 1992-06-09 | — | — | US | claimed |
| US-5120849-A | Reacting cyclic imidoether with aminoalcohol | BASF AKTIENGESELLSCHAFT (DE) | 1992-06-09 | — | — | US | disclosed |
| EP-0244786-B1 | PROCESS FOR PREPARING 0-SUBSTITUTED HYDROXYLAMINES | BASF Aktiengesellschaft (DE) | 1991-03-06 | — | — | EP | disclosed |
| EP-0244786-A1 | Process for preparing 0-substituted hydroxylamines | BASF Aktiengesellschaft (DE) | 1987-11-11 | — | — | EP | disclosed |