⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17867128 | 0.74 | LMNA (0.45) | — | |
| SCHEMBL15064155 | 0.72 | — | — | |
| SCHEMBL790491 | 0.72 | — | — | |
| SCHEMBL790463 | 0.72 | — | — | |
| SCHEMBL789169 | 0.72 | — | — | |
| SCHEMBL14476451 | 0.69 | — | — | |
| SCHEMBL1072920 | 0.69 | — | — | |
| SCHEMBL15372125 | 0.69 | — | — | |
| SCHEMBL12654745 | 0.69 | — | — | |
| SCHEMBL12175788 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0300117-B1 | METHOD OF PREPARING CINEOLES | Union Camp Corporation (US) | 1993-08-04 | — | — | EP | disclosed |
| US-4831163-A | REACTING TERPIN HYDRATE OR TERPINEOL WITH PHOSPHORIC ACID; DISTILLATION | UNION CAMP CORPORATION (US) | 1989-05-16 | — | — | US | disclosed |
| EP-0300117-A2 | Method of preparing cineoles | Union Camp Corporation (US) | 1989-01-25 | — | — | EP | disclosed |
| EP-0270023-A1 | Improved method of preparing cineoles | Union Camp Corporation (US) | 1988-06-08 | — | — | EP | disclosed |