⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27338368 | 0.89 | — | — | |
| SCHEMBL919660 | 0.89 | — | — | |
| SCHEMBL17085640 | 0.75 | — | — | |
| SCHEMBL17079953 | 0.75 | — | — | |
| SCHEMBL17085636 | 0.75 | — | — | |
| SCHEMBL3107279 | 0.73 | — | — | |
| SCHEMBL19921920 | 0.73 | — | — | |
| SCHEMBL37682 | 0.68 | — | — | |
| SCHEMBL13344991 | 0.65 | — | — | |
| SCHEMBL7948270 | 0.64 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0644716-A4 | MEDICAL USES OF TRIOXOLANE AND DIPEROXIDE COMPOUNDS. | — | 1995-04-19 | — | — | EP | disclosed |
| EP-0644716-A1 | MEDICAL USES OF TRIOXOLANE AND DIPEROXIDE COMPOUNDS | HERMAN, Stephen (US) | 1995-03-29 | — | — | EP | disclosed |
| US-5364879-A | Skin disorders, bactericides, fungicides, antiprotozoa agents, viricides and antiinflammatory agents | CLIVEDEN LTD. (BS) | 1994-11-15 | — | — | US | disclosed |
| US-5270344-A | Method of treating a systemic disorder using trioxolane and diperoxide compounds | WESTERN HOLDING COMPANY LIMITED (CH) | 1993-12-14 | — | — | US | disclosed |
| WO-1993012654-A1 | MEDICAL USES OF TRIOXOLANE AND DIPEROXIDE COMPOUNDS | HERMAN STEPHEN (US) | 1993-07-08 | — | — | WO | disclosed |