⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8433424 | 0.98 | — | — | |
| SCHEMBL9584983 | 0.92 | — | — | |
| SCHEMBL8431684 | 0.80 | — | — | |
| SCHEMBL9584536 | 0.71 | HTR3A (0.38) | — | |
| SCHEMBL8434761 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL8432542 | 0.69 | — | — | |
| SCHEMBL22113418 | 0.65 | TSHR (0.50) | — | |
| SCHEMBL10433641 | 0.64 | CHRM2 (0.43) | — | |
| SCHEMBL9052898 | 0.64 | — | — | |
| SCHEMBL8431697 | 0.64 | — | — |
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-0427390-B1 | Azabicyclic compounds, process and intermediates for their preparation and pharmaceutical compositions containing them | BEECHAM GROUP PLC (GB) | 1996-03-27 | — | — | EP | claimed |
| EP-0427390-A2 | Azabicyclic compounds, process and intermediates for their preparation and pharmaceutical compositions containing them | BEECHAM GROUP PLC (GB) | 1991-05-15 | — | — | EP | claimed |