⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27669385 | 1.00 | ALDH1A1 (0.33) | — | |
| SCHEMBL135840 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL2898946 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL377772 | 0.97 | — | — | |
| Dimethylamine SCHEMBL9854034 | 0.91 | — | — | |
| SCHEMBL2932820 | 0.74 | — | — | |
| SCHEMBL5886370 | 0.74 | HTR2A (0.33) | — | |
| SCHEMBL18573462 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL7893161 | 0.71 | TDP1 (0.36) | — | |
| SCHEMBL8388 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6143933-A | Process for the preparation of optically active methadones in high enantiomeric purity | SALFORD ULTRAFINE CHEMICALS & RESEARCH LTD. (GB) | 2000-11-07 | — | — | US | disclosed |
| EP-0914464-A1 | PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE METHADONES IN HIGH ENANTIOMERIC PURITY | SALFORD ULTRAFINE CHEMICALS AND RESEARCH LIMITED (GB) | 1999-05-12 | — | — | EP | disclosed |
| WO-1997045551-A1 | PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE METHADONES IN HIGH ENANTIOMERIC PURITY | SALFORD ULTRAFINE CHEMICALS & RESEARCH LIMITED (GB) | 1997-12-04 | — | — | WO | disclosed |