⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6167542 | 0.59 | — | — | |
| SCHEMBL9728323 | 0.55 | — | — | |
| SCHEMBL8523749 | 0.52 | — | — | |
| SCHEMBL28076060 | 0.43 | — | — | |
| SCHEMBL8624409 | 0.38 | — | — | |
| Carbon Dioxide SCHEMBL28777215 | 0.37 | — | — | |
| SCHEMBL28520803 | 0.37 | — | — | |
| SCHEMBL22977587 | 0.36 | — | — | |
| Water SCHEMBL28533461 | 0.35 | — | — | |
| SCHEMBL18261219 | 0.35 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1498109-A1 | Furan derivatives and dyeing composition comprising a furan derivative as coupler | L'OREAL (FR) | 2005-01-19 | — | — | EP | disclosed |