⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22091 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL8529934 | 0.83 | KDM4E (1.00) | — | |
| Arsenic SCHEMBL28198999 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL135630 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL9118581 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL743762 | 0.83 | — | — | |
| Water SCHEMBL10317431 | 0.83 | — | — | |
| Iodide SCHEMBL11779085 | 0.83 | — | — | |
| SCHEMBL28236278 | 0.83 | — | — | |
| Dimethylamine SCHEMBL11133653 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0521620-B1 | Removal of residual monomers from polymers | ZENECA RESINS BV (NL) | 1997-08-20 | — | — | EP | disclosed |
| US-5292660-A | Removal of residual monomers from polymers using peroxide-generating enzyme | ICI Resin BV | 1994-03-08 | — | — | US | disclosed |
| EP-0521620-A1 | Removal of residual monomers from polymers | ZENECA RESINS BV (NL) | 1993-01-07 | — | — | EP | disclosed |