⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL28037087 | 0.92 | — | — | |
| SCHEMBL2011229 | 0.92 | — | — | |
| SCHEMBL1332032 | 0.92 | — | — | |
| SCHEMBL13629 | 0.92 | — | — | |
| SCHEMBL326193 | 0.92 | ALDH1A1 (0.47) | — | |
| Fluoride SCHEMBL28382077 | 0.92 | — | — | |
| SCHEMBL1332336 | 0.92 | — | — | |
| Fluoride SCHEMBL5345765 | 0.92 | — | — | |
| SCHEMBL20546841 | 0.92 | ALDH1A1 (0.47) | — | |
| SCHEMBL6099331 | 0.88 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0172685-B1 | CURING AGENT FOR THERMOSETTING RESIN PAINTS | KANSAI PAINT CO., LTD. (JP) | 1990-05-23 | — | — | EP | disclosed |
| US-4720569-A | Curing agent for thermosetting resin paints | KANSAI PAINT CO., LTD. (JP) | 1988-01-19 | — | — | US | disclosed |
| EP-0172685-A2 | Curing agent for thermosetting resin paints | KANSAI PAINT CO., LTD. (JP) | 1986-02-26 | — | — | EP | disclosed |