⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL459878 | 0.88 | HCAR2 (0.32) | — | |
| SCHEMBL5924077 | 0.58 | CHRNB2 (0.40) | — | |
| SCHEMBL1242445 | 0.55 | FPR1 (0.47) | — | |
| SCHEMBL22469741 | 0.53 | CXCR5 (0.36) | — | |
| SCHEMBL2420370 | 0.52 | FPR1 (0.52) | — | |
| SCHEMBL4075098 | 0.52 | CHRNB2 (0.35) | — | |
| SCHEMBL1528368 | 0.50 | DPP4 (0.37) | — | |
| SCHEMBL21176841 | 0.49 | DEGS1 (0.36) | — | |
| SCHEMBL10328685 | 0.49 | KDM4E (0.41) | — | |
| SCHEMBL22653989 | 0.49 | DEGS1 (0.60) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011147951-A1 | CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS | PROSIDION LIMITED (GB) | 2011-12-01 | — | — | WO | disclosed |