⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL5035771 | 1.00 | — | — | |
| SCHEMBL29816 | 0.95 | — | — | |
| SCHEMBL9504478 | 0.90 | LAP3 (0.35) | — | |
| SCHEMBL19198171 | 0.90 | — | — | |
| SCHEMBL8030971 | 0.90 | — | — | |
| SCHEMBL8009121 | 0.90 | — | — | |
| Propane SCHEMBL5395474 | 0.90 | LAP3 (0.35) | — | |
| SCHEMBL5615809 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL11054970 | 0.90 | LAP3 (0.35) | — | |
| Barium SCHEMBL4907529 | 0.90 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107427428-A | Gargle liquid formulation | 加巴国际股份有限公司 | 2017-12-01 | — | — | CN | disclosed |
| CN-107223047-A | Gargle liquid formulation | 加巴国际股份有限公司 | 2017-09-29 | — | — | CN | disclosed |
| EP-0959872-A4 | METHODS, COMPOSITIONS, AND DENTAL DELIVERY SYSTEMS FOR THE PROTECTION OF THE SURFACES OF TEETH | FOUR STAR PARTNERS (US) | 2000-08-23 | — | — | EP | disclosed |
| EP-0959872-A1 | METHODS, COMPOSITIONS, AND DENTAL DELIVERY SYSTEMS FOR THE PROTECTION OF THE SURFACES OF TEETH | Four Star Partners (US) | 1999-12-01 | — | — | EP | disclosed |
| WO-1998002136-A9 | METHODS, COMPOSITIONS, AND DENTAL DELIVERY SYSTEMS FOR THE PROTECTION OF THE SURFACES OF TEETH | — | 1998-05-28 | — | — | WO | disclosed |
| WO-1998002136-A1 | METHODS, COMPOSITIONS, AND DENTAL DELIVERY SYSTEMS FOR THE PROTECTION OF THE SURFACES OF TEETH | HOMOLA ANDREW M (US) | 1998-01-22 | — | — | WO | disclosed |