⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL523777 | 0.71 | — | — | |
| SCHEMBL9330509 | 0.63 | — | — | |
| SCHEMBL279520 | 0.61 | — | — | |
| SCHEMBL30032683 | 0.60 | — | — | |
| SCHEMBL523260 | 0.60 | — | — | |
| SCHEMBL622463 | 0.57 | — | — | |
| SCHEMBL10698864 | 0.56 | — | — | |
| SCHEMBL5894132 | 0.54 | CRBN (0.33) | — | |
| SCHEMBL5163762 | 0.52 | — | — | |
| SCHEMBL2588975 | 0.52 | — | — |
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-2012085166-A1 | METABOTROPIC GLUTAMATE RECEPTOR MODULATORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2012-06-28 | — | — | WO | disclosed |