⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4312507 | 1.00 | — | — | |
| SCHEMBL3992253 | 0.90 | ALDH1A1 (0.31) | — | |
| SCHEMBL18530055 | 0.86 | LPL (0.34) | — | |
| Pyrrole SCHEMBL28272474 | 0.81 | CHRNA7 (0.31) | — | |
| SCHEMBL27795078 | 0.81 | — | — | |
| SCHEMBL27956721 | 0.81 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL1001072 | 0.80 | — | — | |
| SCHEMBL27842607 | 0.79 | — | — | |
| SCHEMBL27900731 | 0.79 | — | — | |
| Carbazole SCHEMBL27601318 | 0.77 | ALDH1A1 (0.41) | — |
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-105924605-B | A kind of manufacture method of stretchy nylon internal supporting body for tyre | 天津爱尼机电有限公司 | 2018-05-15 | — | — | CN | claimed |