⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19407528 | 1.00 | — | — | |
| SCHEMBL6552363 | 0.81 | — | — | |
| SCHEMBL6244826 | 0.78 | — | — | |
| SCHEMBL216698 | 0.78 | — | — | |
| SCHEMBL9752720 | 0.76 | — | — | |
| SCHEMBL1299225 | 0.74 | ADRA2A (0.35) | — | |
| SCHEMBL14917574 | 0.73 | ADRA2A (0.33) | — | |
| SCHEMBL25266 | 0.73 | — | — | |
| SCHEMBL25330297 | 0.73 | — | — | |
| SCHEMBL11211931 | 0.72 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111849154-A | Preparation method of novel nylon | 江苏恒峰线缆有限公司 | 2020-10-30 | — | — | CN | disclosed |