⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7213252 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL5909748 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL5909726 | 0.65 | — | — | |
| SCHEMBL6267274 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL7639243 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL4885094 | 0.57 | — | — | |
| SCHEMBL12822289 | 0.54 | — | — | |
| SCHEMBL7570536 | 0.53 | — | — | |
| SCHEMBL4470037 | 0.52 | — | — | |
| Hydrochloric Acid SCHEMBL19512568 | 0.52 | — | — |
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-1605000-A1 | ULTRAHIGH-MOLECULAR ETHYLENE POLYMER | Asahi Kasei Chemicals Corporation (JP) | 2005-12-14 | — | — | EP | disclosed |