⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7285048 | 0.83 | TAAR1 (0.34) | — | |
| SCHEMBL7287110 | 0.76 | ALDH1A1 (0.37) | — | |
| SCHEMBL9866719 | 0.68 | L3MBTL1 (0.38) | — | |
| SCHEMBL9865854 | 0.67 | HCAR1 (0.39) | — | |
| SCHEMBL9867797 | 0.67 | MEN1 (0.33) | — | |
| SCHEMBL7295603 | 0.67 | ALDH1A1 (0.36) | — | |
| SCHEMBL10562882 | 0.65 | GPR84 (0.33) | — | |
| SCHEMBL10746083 | 0.63 | LMNA (0.37) | — | |
| SCHEMBL7295305 | 0.63 | GPR84 (0.38) | — | |
| SCHEMBL10745161 | 0.62 | DRD2 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4863938-A | Pyridine derivatives and their use as nootropic agents | CIBA-GEIGY CORPORATION (US) | 1989-09-05 | — | — | US | disclosed |