⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28786739 | 0.67 | — | — | |
| SCHEMBL7218331 | 0.66 | — | — | |
| SCHEMBL6029531 | 0.59 | — | — | |
| SCHEMBL20377043 | 0.57 | — | — | |
| Nitric Acid SCHEMBL7924915 | 0.54 | CA5A (0.42) | — | |
| Nitric Acid SCHEMBL7924910 | 0.54 | CA5A (0.42) | — | |
| Nitric Acid SCHEMBL2183961 | 0.54 | — | — | |
| SCHEMBL28902208 | 0.53 | — | — | |
| Diethanolamine SCHEMBL9901053 | 0.53 | CA5A (0.47) | — | |
| Diethanolamine SCHEMBL8754524 | 0.53 | CA5A (0.47) | — |
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-119997925-A | Combinations comprising glucamide and co-emulsifiers | 科莱恩国际有限公司 | 2025-05-13 | — | — | CN | disclosed |
| CN-119584861-A | Antimicrobial combinations | 科莱恩国际有限公司 | 2025-03-07 | — | — | CN | disclosed |