⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9836627 | 0.75 | — | — | |
| SCHEMBL2045745 | 0.75 | — | — | |
| SCHEMBL3084499 | 0.66 | CYP2C19 (0.39) | — | |
| SCHEMBL5706274 | 0.62 | — | — | |
| SCHEMBL845998 | 0.62 | — | — | |
| SCHEMBL534090 | 0.62 | — | — | |
| SCHEMBL14272008 | 0.59 | — | — | |
| SCHEMBL12633927 | 0.57 | — | — | |
| SCHEMBL131709 | 0.57 | — | — | |
| SCHEMBL845771 | 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-0534216-B1 | Dihydropyran derivatives and plant protecting agents containing them | BASF AG (DE) | 1998-08-19 | — | — | EP | disclosed |
| US-5536734-A | FUNGICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1996-07-16 | — | — | US | disclosed |
| EP-0534216-A1 | Dihydropyran derivatives and plant protecting agents containing them | BASF Aktiengesellschaft (DE) | 1993-03-31 | — | — | EP | disclosed |