⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13380942 | 0.77 | ALDH1A1 (0.31) | — | |
| SCHEMBL29306946 | 0.70 | ALDH1A1 (0.31) | — | |
| Propylene Oxide SCHEMBL1717596 | 0.66 | CHRM2 (0.33) | — | |
| SCHEMBL10618204 | 0.66 | — | — | |
| Propylene Oxide SCHEMBL1717411 | 0.66 | CHRM2 (0.33) | — | |
| SCHEMBL11393259 | 0.65 | — | — | |
| SCHEMBL13201148 | 0.65 | — | — | |
| SCHEMBL8995815 | 0.65 | — | — | |
| SCHEMBL264756 | 0.65 | — | — | |
| SCHEMBL13201151 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20050025978-A1 | Method of finish-coating automotive bodies and finished automotive bodies | NIPPON PAINT CO., LTD. (JP) | 2005-02-03 | — | — | US | disclosed |
| EP-1486263-A2 | Method of finish-coating automotive bodies and finished automotive bodies | Nippon Paint Co., Ltd. (JP) | 2004-12-15 | — | — | EP | disclosed |