⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11098001 | 0.69 | — | — | |
| SCHEMBL1333554 | 0.69 | — | — | |
| SCHEMBL1335709 | 0.69 | — | — | |
| SCHEMBL17856128 | 0.61 | — | — | |
| SCHEMBL22654704 | 0.61 | — | — | |
| SCHEMBL17839722 | 0.61 | — | — | |
| SCHEMBL22672658 | 0.61 | — | — | |
| SCHEMBL19309608 | 0.57 | — | — | |
| SCHEMBL19309766 | 0.57 | — | — | |
| SCHEMBL19309630 | 0.57 | — | — |
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-0031966-B1 | SUBSTITUTED NORBORNANONE ACETALS, PROCESS FOR PREPARING THE SAME, AND PERFUME COMPOSITIONS CONTAINING THE SAME | NIPPON PETROCHEMICALS COMPANY LIMITED (JP) | 1984-05-23 | — | — | EP | disclosed |
| US-4331569-A | PERFUMES | NIPPON PETROCHEMICALS CO., LTD. (JP) | 1982-05-25 | — | — | US | disclosed |
| EP-0031966-A1 | Substituted norbornanone acetals, process for preparing the same, and perfume compositions containing the same | NIPPON PETROCHEMICALS COMPANY LIMITED (JP) | 1981-07-15 | — | — | EP | disclosed |