⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4838085 | 1.00 | — | — | |
| SCHEMBL4837975 | 1.00 | — | — | |
| SCHEMBL7651778 | 0.86 | — | — | |
| SCHEMBL8164138 | 0.81 | DRD2 (0.50) | — | |
| SCHEMBL7026919 | 0.81 | DRD2 (0.50) | — | |
| SCHEMBL6817145 | 0.81 | DRD2 (0.50) | — | |
| SCHEMBL5759457 | 0.81 | DRD2 (0.51) | — | |
| SCHEMBL4830434 | 0.81 | DRD2 (0.51) | — | |
| SCHEMBL4838334 | 0.81 | DRD2 (0.51) | — | |
| Hydrochloric Acid SCHEMBL6823030 | 0.80 | DRD2 (0.50) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1025096-A1 | SUBSTITUTED CHROMAN DERIVATIVES | AstraZeneca AB (SE) | 2000-08-09 | — | — | EP | disclosed |
| WO-1999014213-A1 | SUBSTITUTED CHROMAN DERIVATIVES | ASTRAZENECA AB (SE) | 1999-03-25 | — | — | WO | disclosed |