⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9304889 | 1.00 | — | — | |
| SCHEMBL9564551 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL26672234 | 0.98 | GABRR1 (0.42) | — | |
| SCHEMBL14965758 | 0.75 | — | — | |
| SCHEMBL44685 | 0.73 | SUCNR1 (0.39) | — | |
| SCHEMBL28269914 | 0.73 | GABRR1 (0.36) | — | |
| SCHEMBL7140751 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL1189461 | 0.71 | SUCNR1 (0.38) | — | |
| SCHEMBL322324 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL628216 | 0.71 | SUCNR1 (0.38) | — |
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-0538688-A1 | Substituted tetrahydrofurans, methods for their preparation, and their use as pharmaceutical compositions | BAYER AG (DE) | 1993-04-28 | — | — | EP | disclosed |