⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL728960 | 0.78 | — | — | |
| SCHEMBL16996698 | 0.76 | — | — | |
| SCHEMBL14883403 | 0.74 | — | — | |
| SCHEMBL756966 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL677687 | 0.71 | — | — | |
| SCHEMBL860348 | 0.71 | — | — | |
| SCHEMBL22319210 | 0.70 | — | — | |
| SCHEMBL8363456 | 0.70 | — | — | |
| SCHEMBL239311 | 0.69 | — | — | |
| SCHEMBL239255 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011148323-A1 | COSMETIC COMPOSITION BASED ON A SUPRAMOLECULAR POLYMER AND A SILICONE ELASTOMER | L'OREAL (FR) | 2011-12-01 | — | — | WO | disclosed |