⚠ 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 SCHEMBL713086 | 0.99 | POLB (0.30) | — | |
| SCHEMBL7929113 | 0.92 | ALDH1A1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL714801 | 0.90 | — | — | |
| SCHEMBL7622791 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL717974 | 0.86 | POLB (0.31) | — | |
| SCHEMBL7931686 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL715320 | 0.85 | — | — | |
| SCHEMBL3229260 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL719809 | 0.84 | — | — | |
| SCHEMBL5086537 | 0.83 | — | — |
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-6187889-B1 | COPOLYMER OF AN ALPHA-OLEFIN WITH AN ALKENYL AROMATIC HYDROCARBON, HAVING A STRUCTURE AT WHICH TERTIARY CARBON ATOMS ARE MUTUALLY SEPARATED BY TWO METHYLENE GROUPS IN THE BACKBONE OF THE COPOLYMER; STRETCHING, WRAPPING FILMS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2001-02-13 | — | — | US | disclosed |