⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11569766 | 0.73 | — | — | |
| SCHEMBL10422 | 0.73 | — | — | |
| SCHEMBL126663 | 0.73 | — | — | |
| Water SCHEMBL21525772 | 0.73 | — | — | |
| SCHEMBL29502566 | 0.73 | — | — | |
| Water SCHEMBL27627574 | 0.73 | ALDH1A1 (0.42) | — | |
| SCHEMBL20472689 | 0.73 | ALDH1A1 (0.42) | — | |
| SCHEMBL30287854 | 0.73 | — | — | |
| SCHEMBL398945 | 0.71 | — | — | |
| SCHEMBL1922588 | 0.71 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8911761-B2 | Composite materials | OXFORD BIOMATERIALS LIMITED (GB) | 2014-12-16 | — | — | US | disclosed |
| US-20100184887-A1 | HYBRID NANOPARTICLES | BASF SE (DE) | 2010-07-22 | — | — | US | disclosed |
| EP-1729832-A2 | COMPOSITE MATERIALS | Oxford Biomaterials Limited (GB) | 2006-12-13 | — | — | EP | disclosed |
| WO-2005094911-A2 | COMPOSITE MATERIALS | OXFORD BIOMATERIALS LIMITED (GB) | 2005-10-13 | — | — | WO | disclosed |