⚠ 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 SCHEMBL820533 | 0.99 | — | — | |
| SCHEMBL3825529 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL713882 | 0.90 | — | — | |
| SCHEMBL7590411 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL819234 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL712699 | 0.88 | — | — | |
| SCHEMBL11897170 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL818953 | 0.86 | — | — | |
| SCHEMBL5085766 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL717985 | 0.84 | — | — |
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-6288193-B1 | Ethylene-based polymer | SUMITOMO CHEMICAL CO., LTD. (JP) | 2001-09-11 | — | — | US | disclosed |