⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL125659 | 1.00 | — | — | |
| SCHEMBL9872514 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL28334257 | 0.95 | — | — | |
| SCHEMBL9764578 | 0.95 | — | — | |
| SCHEMBL30091 | 0.94 | — | — | |
| SCHEMBL11406677 | 0.94 | ALDH1A1 (0.40) | — | |
| Hydrochloric Acid SCHEMBL15210 | 0.89 | — | — | |
| Phosphine SCHEMBL28673109 | 0.89 | — | — | |
| SCHEMBL29278285 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL496907 | 0.89 | ALDH1A1 (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117986421-A | Preparation method of cycloolefin copolymer | 中国科学院长春应用化学研究所 | 2024-05-07 | — | — | CN | disclosed |
| CN-1069113-C | Part of washing machine | MATSASHITA ELECTRIC IND CO LTD (JP) | 2001-08-01 | — | — | CN | disclosed |
| CN-1109528-A | Part of washing machine | MATSASHITA ELECTRIC IND CO LTD (JP) | 1995-10-04 | — | — | CN | disclosed |