⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7371567 | 0.85 | GPR84 (0.58) | — | |
| SCHEMBL20734513 | 0.84 | GPR84 (0.61) | — | |
| SCHEMBL20734517 | 0.84 | GPR84 (0.61) | — | |
| SCHEMBL7436725 | 0.81 | — | — | |
| SCHEMBL3662908 | 0.77 | — | — | |
| SCHEMBL156784 | 0.74 | ATAD2 (0.48) | — | |
| SCHEMBL7039627 | 0.72 | USP2 (0.51) | — | |
| SCHEMBL20822090 | 0.71 | — | — | |
| SCHEMBL11174806 | 0.71 | ATAD2 (0.40) | — | |
| SCHEMBL2775601 | 0.71 | GPR84 (0.72) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0731648-B1 | FLAVOURING COMPOSITIONS AND METHOD | FIRMENICH & CIE (CH) | 2003-03-26 | — | — | EP | claimed |
| US-20230338571-A1 | THIENOAZEPINE IMMUNOCONJUGATES, AND USES THEREOF | BOLT BIOTHERAPEUTICS, INC. (US) | 2023-10-26 | — | — | US | disclosed |
| US-4405628-A | 4-Pyridylimidazolones and method of use | MERRELL DOW PHARMACEUTICALS INC. (US) | 1983-09-20 | — | — | US | disclosed |
| EP-0059948-A1 | Novel aroylimidazolones | MERRELL DOW PHARMACEUTICALS INC. (US) | 1982-09-15 | — | — | EP | disclosed |