⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL220623 | 0.96 | — | — | |
| SCHEMBL17985461 | 0.92 | — | — | |
| SCHEMBL17958370 | 0.92 | — | — | |
| SCHEMBL442687 | 0.72 | LMNA (0.30) | — | |
| SCHEMBL17985467 | 0.69 | — | — | |
| SCHEMBL17985460 | 0.69 | — | — | |
| SCHEMBL16935761 | 0.67 | — | — | |
| SCHEMBL27752228 | 0.64 | — | — | |
| SCHEMBL5361714 | 0.64 | — | — | |
| SCHEMBL28562844 | 0.62 | TAS2R38 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5340707-A | Containing specified pyrazolone dye; storage stability | KONICA CORPORATION (JP) | 1994-08-23 | — | — | US | disclosed |