⚠ 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 SCHEMBL8462868 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL8460327 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL8461680 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL9010012 | 0.64 | — | — | |
| SCHEMBL29180612 | 0.64 | — | — | |
| SCHEMBL2466575 | 0.62 | AURKA (0.32) | — | |
| Hydrochloric Acid SCHEMBL8459507 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL8459884 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL8523689 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL8459759 | 0.60 | — | — |
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-0741145-B1 | Olefin polymerization catalyst and process for producing polyolefin using the same | SUMITOMO CHEMICAL CO (JP) | 1999-12-29 | — | — | EP | claimed |