⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11028673 | 0.65 | L3MBTL1 (0.33) | — | |
| SCHEMBL12493384 | 0.58 | — | — | |
| SCHEMBL9940905 | 0.55 | — | — | |
| SCHEMBL9600238 | 0.54 | — | — | |
| SCHEMBL9727772 | 0.54 | GRIA2 (0.32) | — | |
| SCHEMBL31073660 | 0.52 | HSP90AA1 (0.35) | — | |
| SCHEMBL30659963 | 0.51 | — | — | |
| SCHEMBL4131749 | 0.51 | — | — | |
| Fluoride SCHEMBL28088903 | 0.48 | — | — | |
| SCHEMBL16963308 | 0.48 | EGLN1 (0.47) | — |
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-2008037888-A2 | TETRACYCLIC COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME AND USE THEREOF AS DOPAMINERGIC RECEPTOR LIGANDS | LES LABORATOIRES SERVIER (FR) | 2008-04-03 | — | — | WO | disclosed |