⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6206185 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL6169113 | 0.78 | POLB (0.31) | — | |
| SCHEMBL6168779 | 0.76 | SMN1; SMN2 (0.51) | — | |
| SCHEMBL27266272 | 0.66 | ALDH1A1 (0.40) | — | |
| SCHEMBL9435372 | 0.64 | ALDH1A1 (0.38) | — | |
| SCHEMBL6167527 | 0.63 | — | — | |
| SCHEMBL28288019 | 0.60 | TSHR (0.36) | — | |
| SCHEMBL27756819 | 0.60 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL6169943 | 0.60 | — | — | |
| SCHEMBL8127892 | 0.59 | — | — |
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-1498109-A1 | Furan derivatives and dyeing composition comprising a furan derivative as coupler | L'OREAL (FR) | 2005-01-19 | — | — | EP | claimed |
| EP-1498109-A1 | Furan derivatives and dyeing composition comprising a furan derivative as coupler | L'OREAL (FR) | 2005-01-19 | — | — | EP | disclosed |