⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5024271 | 0.66 | — | — | |
| SCHEMBL30491995 | 0.64 | IDO1 (0.32) | — | |
| SCHEMBL1000925 | 0.64 | — | — | |
| SCHEMBL999429 | 0.64 | ADRA1A (0.32) | — | |
| SCHEMBL1992898 | 0.62 | — | — | |
| SCHEMBL24804359 | 0.61 | AR (0.31) | — | |
| Bromide SCHEMBL9840221 | 0.60 | — | — | |
| SCHEMBL23349325 | 0.59 | — | — | |
| SCHEMBL19724585 | 0.57 | LPO (0.30) | — | |
| SCHEMBL16353275 | 0.56 | CRBN (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6117940-A | SOLID PHASE SYNTHESIS OF COMPOUNDS SUCH AS THE IMIDAZOLES, BENZODIAZEPINES, PYRAZINES, AND STEROID MIMICS. | ADVANCED SYNTECH, LLC, A KENTUCKY LIMITED LIABILITY CORPORATION | 2000-09-12 | — | — | US | disclosed |