⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9903007 | 0.64 | — | — | |
| SCHEMBL19073205 | 0.58 | AHR (0.46) | — | |
| SCHEMBL9901350 | 0.56 | — | — | |
| SCHEMBL12767136 | 0.55 | CYP1A2 (0.31) | — | |
| SCHEMBL765340 | 0.55 | — | — | |
| SCHEMBL19367806 | 0.51 | — | — | |
| SCHEMBL6151302 | 0.51 | — | — | |
| SCHEMBL18789831 | 0.51 | — | — | |
| SCHEMBL19335605 | 0.51 | — | — | |
| SCHEMBL5538037 | 0.51 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012076288-A1 | COMPOSITE COMPRISING NANOPARTICLES AND METHOD OF MAKING NANOPARTICLES | UNIVERSITE DE LIEGE (BE) | 2012-06-14 | — | — | WO | disclosed |
| EP-2462898-A1 | Composite comprising nanoparticles and method for making nanoparticles | Université de Liège (BE) | 2012-06-13 | — | — | EP | disclosed |