⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11854973 | 0.69 | L3MBTL1 (0.34) | — | |
| SCHEMBL11843855 | 0.67 | MAPT (0.33) | — | |
| SCHEMBL14907173 | 0.67 | — | — | |
| SCHEMBL14907287 | 0.67 | — | — | |
| SCHEMBL8883180 | 0.66 | — | — | |
| SCHEMBL14477929 | 0.65 | — | — | |
| SCHEMBL4409586 | 0.65 | ADRA2C (0.35) | — | |
| SCHEMBL8958860 | 0.64 | — | — | |
| SCHEMBL12344121 | 0.62 | TP53 (0.32) | — | |
| SCHEMBL13178870 | 0.62 | TP53 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0869126-B1 | Dithiolan derivatives, their preparation and their therapeutic effect | SANKYO CO (JP) | 2002-07-31 | — | — | EP | disclosed |
| EP-0869126-A1 | Dithiolan derivatives, their preparation and their therapeutic effect | Sankyo Company Limited (JP) | 1998-10-07 | — | — | EP | disclosed |
| US-3973968-A | YELLOW | KONISHIROKU PHOTO INDUSTRY CO., LTD. (JA) | 1976-08-10 | — | — | US | disclosed |