⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL76356 | 0.82 | — | — | |
| SCHEMBL4886096 | 0.82 | — | — | |
| SCHEMBL9120253 | 0.67 | — | — | |
| SCHEMBL9118356 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL3358391 | 0.67 | — | — | |
| SCHEMBL7709260 | 0.67 | GSK3B (0.33) | — | |
| SCHEMBL6540198 | 0.67 | — | — | |
| SCHEMBL1001040 | 0.67 | — | — | |
| Lithium Ion SCHEMBL2022830 | 0.67 | — | — | |
| SCHEMBL6540601 | 0.67 | — | — |
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-6368718-B1 | Structural steel elements coated with anticorrosive coatings and process for welding the same | DAIMLERCHRYSLER AG (DE) | 2002-04-09 | — | — | US | disclosed |