⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4279379 | 1.00 | — | — | |
| SCHEMBL4556119 | 0.72 | — | — | |
| SCHEMBL8474678 | 0.69 | — | — | |
| SCHEMBL270257 | 0.69 | — | — | |
| SCHEMBL1242964 | 0.69 | — | — | |
| SCHEMBL6523505 | 0.69 | — | — | |
| SCHEMBL18396845 | 0.69 | — | — | |
| SCHEMBL28832265 | 0.69 | — | — | |
| SCHEMBL10585972 | 0.69 | — | — | |
| SCHEMBL6052979 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4782052-A | ANTIULCER | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1988-11-01 | — | — | US | disclosed |
| EP-0177361-A2 | Octahydroindolo-[2,3-a]quinolizin-l-yl-alkanecarboxylic acid amides and salts thereof | RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) | 1986-04-09 | — | — | EP | disclosed |