⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL85761 | 0.70 | — | — | |
| SCHEMBL12829711 | 0.67 | — | — | |
| Methane SCHEMBL27605840 | 0.67 | — | — | |
| SCHEMBL10554952 | 0.67 | — | — | |
| SCHEMBL18648831 | 0.67 | — | — | |
| SCHEMBL29414 | 0.64 | — | — | |
| SCHEMBL6061107 | 0.64 | — | — | |
| SCHEMBL25261241 | 0.64 | — | — | |
| SCHEMBL538180 | 0.64 | — | — | |
| SCHEMBL14537963 | 0.64 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0284649-A1 | Vulcanisation accelerator | Firma Carl Freudenberg (DE) | 1988-10-05 | — | — | EP | disclosed |
| EP-0283552-A1 | Vulcanisation accelerator | Firma Carl Freudenberg (DE) | 1988-09-28 | — | — | EP | disclosed |