⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12425152 | 0.68 | — | — | |
| SCHEMBL7383351 | 0.62 | — | — | |
| SCHEMBL17994212 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL2443920 | 0.60 | — | — | |
| SCHEMBL13837537 | 0.57 | — | — | |
| SCHEMBL7383348 | 0.52 | — | — | |
| SCHEMBL655806 | 0.50 | — | — | |
| SCHEMBL8994422 | 0.50 | — | — | |
| SCHEMBL12425151 | 0.46 | — | — | |
| SCHEMBL7145560 | 0.42 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998017646-A1 | 1-(4-PIPERDINYL)-PIPERIDINYLENE AS AGGREGATION INHIBITOR | DR. KARL THOMAE GMBH (DE) | 1998-04-30 | — | — | WO | disclosed |