⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL111378 | 1.00 | — | — | |
| SCHEMBL1172267 | 0.76 | — | — | |
| SCHEMBL9164871 | 0.74 | — | — | |
| SCHEMBL20211167 | 0.71 | — | — | |
| SCHEMBL21964079 | 0.69 | ALOX15 (0.30) | — | |
| SCHEMBL21964081 | 0.69 | ALOX15 (0.30) | — | |
| SCHEMBL21772866 | 0.68 | — | — | |
| SCHEMBL25401350 | 0.66 | — | — | |
| SCHEMBL7784020 | 0.66 | — | — | |
| SCHEMBL11725931 | 0.65 | PRKCA (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0466019-B1 | Derivatives of dihydro campholenic aldehyde | GIVAUDAN ROURE INT (CH) | 1995-03-22 | — | — | EP | claimed |
| EP-0466019-A2 | Derivatives of dihydro campholenic aldehyde | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1992-01-15 | — | — | EP | claimed |
| EP-0466019-B1 | Derivatives of dihydro campholenic aldehyde | GIVAUDAN ROURE INT (CH) | 1995-03-22 | — | — | EP | disclosed |
| US-5288701-A | Derivatives of dihydrocampholenic aldehyde | GIVAUDAN-ROURE CORPORATION (US) | 1994-02-22 | — | — | US | disclosed |
| EP-0466019-A2 | Derivatives of dihydro campholenic aldehyde | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1992-01-15 | — | — | EP | disclosed |