⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14606838 | 0.67 | — | — | |
| SCHEMBL19597414 | 0.67 | — | — | |
| SCHEMBL15188573 | 0.65 | — | — | |
| SCHEMBL8738353 | 0.65 | — | — | |
| SCHEMBL17056197 | 0.65 | — | — | |
| SCHEMBL20055707 | 0.62 | — | — | |
| SCHEMBL18599212 | 0.62 | — | — | |
| SCHEMBL22537671 | 0.62 | — | — | |
| SCHEMBL12656217 | 0.61 | — | — | |
| SCHEMBL18833856 | 0.61 | — | — |
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-2012064603-A1 | OXAZOLIDINONES AS MODULATORS OF MGLUR5 | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-05-18 | — | — | WO | disclosed |