⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10442003 | 1.00 | — | — | |
| SCHEMBL9424090 | 0.96 | — | — | |
| SCHEMBL9424094 | 0.96 | — | — | |
| SCHEMBL9424382 | 0.92 | — | — | |
| SCHEMBL9424389 | 0.92 | — | — | |
| SCHEMBL683468 | 0.91 | AGTR1 (0.75) | — | |
| SCHEMBL6959201 | 0.91 | AGTR1 (0.75) | — | |
| SCHEMBL9424164 | 0.90 | — | — | |
| SCHEMBL9424158 | 0.90 | — | — | |
| SCHEMBL9424267 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0403158-A2 | Imidazolyl-alkenoic acids | SMITHKLINE BEECHAM CORPORATION (US) | 1990-12-19 | — | — | EP | disclosed |