⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4837578 | 0.80 | TSHR (0.36) | — | |
| SCHEMBL14150381 | 0.80 | FAAH (0.37) | — | |
| SCHEMBL13195784 | 0.78 | — | — | |
| SCHEMBL13195782 | 0.78 | — | — | |
| SCHEMBL609300 | 0.78 | RNPEP (0.44) | — | |
| SCHEMBL25435789 | 0.78 | MAPT (0.41) | — | |
| SCHEMBL149835 | 0.78 | — | — | |
| SCHEMBL320015 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL11861052 | 0.76 | — | — | |
| SCHEMBL6420398 | 0.76 | — | — |
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-20020070472-A1 | Injection moulding method and product | SHAW DONALD (CA) | 2002-06-13 | — | — | US | disclosed |