⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9070325 | 0.73 | — | — | |
| SCHEMBL5006334 | 0.70 | — | — | |
| SCHEMBL4083600 | 0.69 | MAOA (0.44) | — | |
| SCHEMBL14119956 | 0.68 | ALDH1A1 (0.31) | — | |
| SCHEMBL10697572 | 0.67 | — | — | |
| SCHEMBL8563214 | 0.66 | MAOA (0.34) | — | |
| SCHEMBL548282 | 0.66 | MAOA (0.34) | — | |
| SCHEMBL5202489 | 0.63 | MAOA (0.41) | — | |
| SCHEMBL27630042 | 0.63 | MAOA (0.45) | — | |
| SCHEMBL9069209 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5319047-A | Heating N-(hydroxyphenyl)maleamic acid in absence of solvent in presence of acid catalyst; used as an addative for rubber to improve peel adhesion and tear resistance | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1994-06-07 | — | — | US | disclosed |