⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4322101 | 1.00 | — | — | |
| SCHEMBL6947157 | 0.86 | CA2 (0.30) | — | |
| SCHEMBL7941049 | 0.76 | CA1 (0.31) | — | |
| SCHEMBL485743 | 0.73 | CYP3A4 (0.38) | — | |
| SCHEMBL735405 | 0.73 | CYP3A4 (0.38) | — | |
| SCHEMBL6763702 | 0.73 | CYP3A4 (0.38) | — | |
| SCHEMBL6949783 | 0.72 | — | — | |
| SCHEMBL7618395 | 0.72 | CYP3A4 (0.36) | — | |
| SCHEMBL7625046 | 0.72 | CYP3A4 (0.36) | — | |
| SCHEMBL9849222 | 0.72 | CES1 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11840548-B2 | UV-curable phosphonium small molecules as antimicrobial coatings and surface active additives | SCI RESOURCE PLATFORM INC. (CA) | 2023-12-12 | — | — | US | disclosed |
| US-20220056058-A1 | UV-CURABLE PHOSPHONIUM SMALL MOLECULES AS ANTIMICROBIAL COATINGS AND SURFACE ACTIVE ADDITIVES | SCI RESOURCE PLATFORM INC. (CA) | 2022-02-24 | — | — | US | disclosed |
| EP-1051374-B1 | THE USE OF COMPRESSED CARBON DIOXIDE IN CHEMICAL REACTIONS | UNIV CAMBRIDGE TECH (GB) | 2003-10-15 | — | — | EP | disclosed |