⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26439795 | 0.87 | — | — | |
| SCHEMBL1645934 | 0.87 | TSHR (0.32) | — | |
| SCHEMBL26431450 | 0.84 | — | — | |
| SCHEMBL13368910 | 0.74 | VCAM1 (0.30) | — | |
| SCHEMBL23482623 | 0.73 | EPHX2 (0.33) | — | |
| SCHEMBL23543402 | 0.72 | ALDH1A1 (0.32) | — | |
| SCHEMBL12301946 | 0.72 | CES2 (0.44) | — | |
| SCHEMBL22389094 | 0.71 | TSHR (0.32) | — | |
| SCHEMBL1644006 | 0.71 | TSHR (0.36) | — | |
| SCHEMBL13542802 | 0.71 | HMGCR (0.38) | — |
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-4170347-A1 | GASTRIC INHIBITORY PEPTIDE RECEPTOR LIGANDS | 3B Pharmaceuticals GmbH (DE) | 2023-04-26 | — | — | EP | disclosed |