⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27636031 | 0.79 | — | — | |
| SCHEMBL8422150 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL29207405 | 0.74 | — | — | |
| SCHEMBL3788391 | 0.72 | ADRB2 (0.31) | — | |
| SCHEMBL6871658 | 0.71 | — | — | |
| SCHEMBL3535849 | 0.71 | — | — | |
| SCHEMBL11436536 | 0.71 | EPHX1 (0.50) | — | |
| SCHEMBL3422333 | 0.68 | SSTR4 (0.35) | — | |
| SCHEMBL12274071 | 0.67 | — | — | |
| SCHEMBL7319 | 0.67 | — | — |
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 |