⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22167427 | 0.92 | PYGL (0.31) | — | |
| SCHEMBL17492904 | 0.92 | PYGL (0.31) | — | |
| SCHEMBL17492905 | 0.92 | PYGL (0.31) | — | |
| SCHEMBL22167394 | 0.87 | S1PR1 (0.34) | — | |
| SCHEMBL17532367 | 0.87 | S1PR1 (0.34) | — | |
| SCHEMBL17532297 | 0.87 | S1PR1 (0.34) | — | |
| SCHEMBL23838969 | 0.87 | F2 (0.32) | — | |
| SCHEMBL20026802 | 0.87 | F2 (0.32) | — | |
| SCHEMBL23839024 | 0.87 | F2 (0.32) | — | |
| SCHEMBL17532348 | 0.87 | F2 (0.32) | — |
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-3172199-B1 | PYRIMIDINE DERIVATIVES AS GLP-1 RECEPTOR MODULATORS | CELGENE INT II SARL (CH) | 2020-07-01 | — | — | EP | disclosed |