⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3842227 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL3852504 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL3860501 | 0.97 | — | — | |
| SCHEMBL3835511 | 0.89 | CNR1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL3851757 | 0.87 | CNR1 (0.32) | — | |
| SCHEMBL3837848 | 0.81 | CYP2D6 (0.31) | — | |
| SCHEMBL18975389 | 0.80 | — | — | |
| SCHEMBL3840396 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL3853779 | 0.79 | — | — | |
| SCHEMBL16081509 | 0.79 | MEN1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1792903-B1 | Composition for the dyeing of keratin fibres comprising at least one cationic 3-amino-pyrazolopyridine derivative | OREAL (FR) | 2009-10-14 | — | — | EP | disclosed |
| EP-1792903-A1 | Composition for the dyeing of keratin fibres comprising at least one cationic 3-amino-pyrazolopyridine derivative | L'OREAL (FR) | 2007-06-06 | — | — | EP | disclosed |