⚠ 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 | |
|---|---|---|---|---|
| Biguanide SCHEMBL8039 | 0.95 | — | — | |
| Biguanide SCHEMBL18255803 | 0.95 | MAPK1 (0.31) | — | |
| Biguanide SCHEMBL5489883 | 0.91 | — | — | |
| Biguanide SCHEMBL4217126 | 0.91 | — | — | |
| Biguanide SCHEMBL10881314 | 0.91 | — | — | |
| Biguanide SCHEMBL4221594 | 0.91 | — | — | |
| Biguanide SCHEMBL675101 | 0.91 | — | — | |
| Biguanide SCHEMBL1428352 | 0.91 | — | — | |
| Biguanide SCHEMBL31013828 | 0.91 | — | — | |
| Biguanide SCHEMBL28838005 | 0.91 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115322486-A | PPR material antibacterial master batch and preparation method and application thereof | 刘俊杰 | 2022-11-11 | — | — | CN | disclosed |
| CN-115286865-A | Melt-blown antibacterial masterbatch for producing automotive interior antibacterial material and preparation method thereof | 刘俊杰 | 2022-11-04 | — | — | CN | disclosed |