⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7937029 | 0.82 | — | — | |
| SCHEMBL16840698 | 0.82 | — | — | |
| SCHEMBL16840697 | 0.82 | — | — | |
| SCHEMBL16840696 | 0.82 | — | — | |
| SCHEMBL16840695 | 0.82 | — | — | |
| SCHEMBL16840701 | 0.82 | — | — | |
| SCHEMBL29315212 | 0.81 | GRM4 (0.42) | — | |
| SCHEMBL14087164 | 0.80 | EPHX1 (0.37) | — | |
| SCHEMBL17378004 | 0.79 | HTT (0.49) | — | |
| SCHEMBL11290575 | 0.79 | GRM4 (0.41) | — |
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-2022262782-A1 | GLUTARIMIDE-SUBSTITUTED ISOXAZOLE FUSED RING COMPOUND, AND APPLICATION THEREOF | 南京明德新药研发有限公司 | 2022-12-22 | — | — | WO | disclosed |