⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5525403 | 0.70 | — | — | |
| Chloromethane SCHEMBL5050446 | 0.68 | — | — | |
| SCHEMBL7725 | 0.67 | — | — | |
| SCHEMBL2556849 | 0.67 | — | — | |
| SCHEMBL14968279 | 0.67 | — | — | |
| SCHEMBL2770604 | 0.67 | — | — | |
| SCHEMBL562402 | 0.67 | — | — | |
| SCHEMBL3679400 | 0.67 | TSHR (0.46) | — | |
| SCHEMBL352066 | 0.64 | — | — | |
| SCHEMBL22499323 | 0.64 | — | — |
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-114773338-A | Trazodone artificial hapten, trazodone artificial antigen, and preparation methods and applications thereof | 杭州同舟生物技术有限公司 | 2022-07-22 | — | — | CN | claimed |
| CN-114773338-A | Trazodone artificial hapten, trazodone artificial antigen, and preparation methods and applications thereof | 杭州同舟生物技术有限公司 | 2022-07-22 | — | — | CN | disclosed |