⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6765508 | 0.46 | — | — | |
| SCHEMBL723915 | 0.41 | — | — | |
| SCHEMBL14040080 | 0.41 | — | — | |
| SCHEMBL13157175 | 0.41 | — | — | |
| SCHEMBL239887 | 0.36 | — | — | |
| SCHEMBL9738500 | 0.35 | — | — | |
| SCHEMBL11730161 | 0.35 | — | — | |
| SCHEMBL25434707 | 0.26 | — | — | |
| SCHEMBL7781863 | 0.26 | — | — | |
| Methane SCHEMBL23044967 | 0.26 | — | — |
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 |