⚠ 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 SCHEMBL14690145 | 0.98 | — | — | |
| SCHEMBL6914394 | 0.71 | — | — | |
| SCHEMBL8383465 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL5898868 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL7947950 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL6471972 | 0.70 | — | — | |
| SCHEMBL1982035 | 0.68 | — | — | |
| SCHEMBL3827394 | 0.67 | — | — | |
| SCHEMBL19767296 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL716256 | 0.67 | — | — |
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 |