⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2090578 | 1.00 | — | — | |
| SCHEMBL2094998 | 1.00 | — | — | |
| SCHEMBL2093086 | 1.00 | — | — | |
| SCHEMBL8837345 | 0.97 | — | — | |
| SCHEMBL962360 | 0.87 | — | — | |
| SCHEMBL2563930 | 0.83 | LCK (0.32) | — | |
| SCHEMBL30678313 | 0.83 | LCK (0.32) | — | |
| SCHEMBL20494563 | 0.83 | LCK (0.32) | — | |
| SCHEMBL2566428 | 0.83 | LCK (0.32) | — | |
| SCHEMBL2567606 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5599848-A | CONTROLLING CODLING MOTH BY INTERFERING MATING | BASF AKTIENGESELLSCHAFT (DE) | 1997-02-04 | — | — | US | disclosed |
| EP-0609253-B1 | PROCESS FOR PREPARING A MIXTURE OF DODECADIENOL ISOMERS, INTERMEDIATES FOR PREPARING THE SAME AND ITS USE | BASF AG (DE) | 1995-12-20 | — | — | EP | disclosed |
| EP-0609253-A1 | PROCESS FOR PREPARING A MIXTURE OF DODECADIENOL ISOMERS, INTERMEDIATES FOR PREPARING THE SAME AND ITS USE. | BASF AG (DE) | 1994-08-10 | — | — | EP | disclosed |
| WO-1993008148-A1 | PROCESS FOR PREPARING A MIXTURE OF DODECADIENOL ISOMERS, INTERMEDIATES FOR PREPARING THE SAME AND ITS USE | BASF AKTIENGESELLSCHAFT (DE) | 1993-04-29 | — | — | WO | disclosed |