⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL646132 | 0.80 | — | — | |
| SCHEMBL7908874 | 0.71 | — | — | |
| SCHEMBL2045706 | 0.67 | — | — | |
| SCHEMBL644315 | 0.67 | — | — | |
| Ethylene Glycol SCHEMBL11770499 | 0.67 | TSHR (0.31) | — | |
| Oxirane SCHEMBL5690252 | 0.66 | — | — | |
| Oxirane SCHEMBL2594732 | 0.66 | — | — | |
| SCHEMBL9466809 | 0.65 | — | — | |
| SCHEMBL8997440 | 0.65 | — | — | |
| SCHEMBL9467005 | 0.65 | CA1 (0.36) | — |
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-0550007-A2 | Eseroline derivatives having anticholinesterase activity, a process for their preparation and pharmaceutical compositions containing them | AESCULAPIUS FARMACEUTICI S.r.l. (IT) | 1993-07-07 | — | — | EP | disclosed |