⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27419156 | 0.74 | — | — | |
| SCHEMBL84926 | 0.72 | NNMT (0.33) | — | |
| SCHEMBL27419139 | 0.72 | — | — | |
| SCHEMBL27419152 | 0.70 | CHRNB2 (0.34) | — | |
| SCHEMBL27419178 | 0.70 | — | — | |
| SCHEMBL25786380 | 0.70 | — | — | |
| SCHEMBL18898720 | 0.65 | — | — | |
| SCHEMBL27419159 | 0.65 | ADRA2A (0.35) | — | |
| SCHEMBL24317437 | 0.64 | SYK (0.36) | — | |
| SCHEMBL19153514 | 0.64 | — | — |
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-20240217966-A1 | PHARMACEUTICAL COMPOSITION CONTAINING GLP-1 RECEPTOR AGONIST HAVING FUSED RING | SHIONOGI & CO., LTD. (JP) | 2024-07-04 | — | — | US | disclosed |