⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27619972 | 0.71 | — | — | |
| SCHEMBL6454580 | 0.66 | — | — | |
| SCHEMBL27504699 | 0.65 | — | — | |
| SCHEMBL27556463 | 0.65 | — | — | |
| Water SCHEMBL27407080 | 0.64 | — | — | |
| SCHEMBL28070233 | 0.61 | — | — | |
| SCHEMBL7030856 | 0.61 | — | — | |
| SCHEMBL5833115 | 0.61 | SLC7A5 (0.40) | — | |
| Bromide SCHEMBL27891598 | 0.60 | — | — | |
| SCHEMBL10812354 | 0.59 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0641805-B1 | Antimicrobial polymers and compositions containing them | RECKITT & COLMAN INC (US) | 1998-01-07 | — | — | EP | disclosed |
| EP-0641805-A1 | Antimicrobial polymers and compositions containing them | Reckitt & Colman Inc. (US) | 1995-03-08 | — | — | EP | disclosed |