⚠ 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 | |
|---|---|---|---|---|
| Propylamine SCHEMBL15476979 | 0.95 | DNM1 (0.44) | — | |
| Propylamine SCHEMBL7065649 | 0.95 | — | — | |
| Propylamine SCHEMBL2570107 | 0.95 | — | — | |
| Propylamine SCHEMBL3135623 | 0.91 | — | — | |
| Propylamine SCHEMBL1427100 | 0.91 | — | — | |
| Propylamine SCHEMBL3676587 | 0.86 | — | — | |
| Propylamine SCHEMBL5370013 | 0.86 | — | — | |
| Propylamine SCHEMBL28101575 | 0.86 | — | — | |
| Propylamine SCHEMBL28800075 | 0.86 | — | — | |
| Propylamine SCHEMBL27548019 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0880550-A1 | COATING COMPOSITION | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1998-12-02 | — | — | EP | disclosed |
| WO-1997030099-A1 | COATING COMPOSITION | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1997-08-21 | — | — | WO | disclosed |