⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5788018 | 0.72 | — | — | |
| SCHEMBL9876093 | 0.69 | — | — | |
| SCHEMBL5788970 | 0.63 | — | — | |
| SCHEMBL10726749 | 0.63 | — | — | |
| SCHEMBL8650710 | 0.63 | — | — | |
| SCHEMBL7409156 | 0.62 | — | — | |
| SCHEMBL2927534 | 0.62 | — | — | |
| SCHEMBL565453 | 0.62 | — | — | |
| SCHEMBL1541650 | 0.61 | — | — | |
| SCHEMBL29254281 | 0.61 | POLB (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8802105-B2 | Antibacterial compositions | FORSYTH DENTAL INFIRMARY FOR CHILDREN (US) | 2014-08-12 | — | — | US | disclosed |
| US-20130303619-A1 | Antibacterial Compositions | FORSYTH DENTAL INFIRMARY FOR CHILDREN | 2013-11-14 | — | — | US | disclosed |