⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9318950 | 0.94 | — | — | |
| SCHEMBL1774049 | 0.94 | — | — | |
| SCHEMBL3445961 | 0.94 | — | — | |
| SCHEMBL17386389 | 0.89 | — | — | |
| SCHEMBL8345340 | 0.89 | — | — | |
| SCHEMBL12005977 | 0.89 | — | — | |
| SCHEMBL9523114 | 0.89 | — | — | |
| SCHEMBL6702644 | 0.89 | — | — | |
| SCHEMBL1286157 | 0.89 | — | — | |
| SCHEMBL4864219 | 0.89 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8008367-B2 | Composite material and use of a composite material | VOCO GMBH (DE) | 2011-08-30 | — | — | US | disclosed |
| US-20060116438-A1 | Composite material and use of a composite material | VOCO GMBH (DE) | 2006-06-01 | — | — | US | disclosed |