⚠ 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 SCHEMBL6471781 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL6471993 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL6469916 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL6470835 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL6470142 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL6472030 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL7634881 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL27779141 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL27800150 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL6471985 | 0.75 | — | — |
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-0727443-A1 | Catalyst for olefin polymerization and process for producing olefin polymers | Tosoh Corporation (JP) | 1996-08-21 | — | — | EP | disclosed |