⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25436419 | 0.68 | CYP1A2 (0.46) | — | |
| SCHEMBL9836870 | 0.67 | — | — | |
| SCHEMBL9678831 | 0.64 | CHRNA7 (0.36) | — | |
| SCHEMBL9853469 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL9677795 | 0.63 | CHRNA7 (0.35) | — | |
| SCHEMBL8333610 | 0.61 | TSHR (0.35) | — | |
| SCHEMBL12758981 | 0.60 | ALDH1A1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL9853475 | 0.60 | RAB9A (0.37) | — | |
| SCHEMBL23044055 | 0.58 | — | — | |
| SCHEMBL24858554 | 0.58 | — | — |
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-0431605-A2 | 1-Azabicyclo[m.n.O]alkane derivatives, their salts and process for preparing them | SANWA KAGAKU KENKYUSHO CO., LTD. (JP) | 1991-06-12 | — | — | EP | claimed |
| EP-0431605-A2 | 1-Azabicyclo[m.n.O]alkane derivatives, their salts and process for preparing them | SANWA KAGAKU KENKYUSHO CO., LTD. (JP) | 1991-06-12 | — | — | EP | disclosed |