⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2816337 | 0.72 | — | — | |
| SCHEMBL30660633 | 0.67 | — | — | |
| SCHEMBL5644402 | 0.65 | — | — | |
| SCHEMBL2325760 | 0.61 | — | — | |
| SCHEMBL20773250 | 0.59 | TAAR1 (0.50) | — | |
| SCHEMBL2917023 | 0.58 | GABBR2 (0.34) | — | |
| SCHEMBL536125 | 0.57 | — | — | |
| SCHEMBL268204 | 0.55 | — | — | |
| SCHEMBL17339047 | 0.53 | NPSR1 (0.31) | — | |
| SCHEMBL1091555 | 0.52 | — | — |
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-109503421-B | Method for improving safety of azide amine fuel synthesis process | 黎明化工研究设计院有限责任公司 | 2022-10-14 | — | — | CN | claimed |
| CN-109503421-B | Method for improving safety of azide amine fuel synthesis process | 黎明化工研究设计院有限责任公司 | 2022-10-14 | — | — | CN | disclosed |