⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20113009 | 0.69 | — | — | |
| SCHEMBL2267198 | 0.51 | — | — | |
| SCHEMBL13800327 | 0.48 | — | — | |
| SCHEMBL723744 | 0.46 | — | — | |
| SCHEMBL723915 | 0.46 | — | — | |
| SCHEMBL3248263 | 0.46 | — | — | |
| SCHEMBL42375 | 0.46 | — | — | |
| SCHEMBL7633862 | 0.44 | TRIM24 (0.38) | — | |
| SCHEMBL8951634 | 0.44 | — | — | |
| Calcium SCHEMBL9143564 | 0.44 | — | — |
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-2018079862-A1 | MGLUR7 MODULATORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-05-03 | — | — | WO | disclosed |