⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28170260 | 1.00 | — | — | |
| SCHEMBL8468740 | 1.00 | — | — | |
| SCHEMBL23663 | 1.00 | — | — | |
| SCHEMBL28395572 | 1.00 | — | — | |
| SCHEMBL3748751 | 0.71 | — | — | |
| Hydrogen Sulfide SCHEMBL635101 | 0.71 | — | — | |
| SCHEMBL22418868 | 0.71 | — | — | |
| SCHEMBL21051633 | 0.71 | — | — | |
| SCHEMBL22227757 | 0.71 | — | — | |
| SCHEMBL10952253 | 0.71 | — | — |
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-5888491-A | DENTAL COMPOSITION SUITABLE FOR COATING HUMAN ORAL SURFACES TO REDUCE ADHESION OF BACTERIA | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1999-03-30 | — | — | US | disclosed |
| US-5876208-A | Optionally crosslinkable coatings for orthodontic devices | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1999-03-02 | — | — | US | disclosed |