⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2208010 | 0.92 | TSHR (0.39) | — | |
| SCHEMBL12019019 | 0.88 | TSHR (0.36) | — | |
| SCHEMBL11854035 | 0.88 | TSHR (0.36) | — | |
| SCHEMBL9843580 | 0.87 | — | — | |
| SCHEMBL3086442 | 0.84 | — | — | |
| SCHEMBL11854943 | 0.84 | — | — | |
| SCHEMBL4969205 | 0.82 | — | — | |
| SCHEMBL2205406 | 0.82 | — | — | |
| SCHEMBL6888664 | 0.82 | — | — | |
| SCHEMBL10457266 | 0.79 | KMT2A (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0454444-A1 | Glutarimide derivatives and herbicides | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1991-10-30 | — | — | EP | disclosed |