⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7639243 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL4885094 | 0.76 | — | — | |
| SCHEMBL12822289 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL5909726 | 0.72 | — | — | |
| SCHEMBL6267273 | 0.72 | — | — | |
| SCHEMBL7570536 | 0.70 | — | — | |
| SCHEMBL4470037 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL19512568 | 0.69 | — | — | |
| SCHEMBL15014044 | 0.68 | GPR3 (0.30) | — | |
| SCHEMBL7647010 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1275662-A1 | MODIFIED PARTICLE, SUPPORT, CATALYST COMPONENT FOR ADDITION POLYMERIZATION, CATALYST FOR ADDITION POLYMERIZATION, AND PROCESS FOR PRODUCING ADDITION POLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2003-01-15 | — | — | EP | disclosed |