Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 20/20 | 0.71 |
| ▸ | HCRTR2 | O43614 | 20/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL27029839 | 1.00 | HCRTR1 (0.71) | HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL4306752 | 0.83 | HCRTR2 (0.88) | HCRTR1HCRTR2 | |
| SCHEMBL4321503 | 0.83 | HCRTR2 (0.88) | HCRTR1HCRTR2 | |
| SCHEMBL1671677 | 0.80 | HCRTR1 (1.00) | HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL27029914 | 0.80 | HCRTR1 (0.80) | HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL27029853 | 0.79 | HCRTR1 (0.89) | HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL29930918 | 0.79 | HCRTR1 (0.75) | HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL1586887 | 0.79 | HCRTR1 (1.00) | HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL27055025 | 0.79 | HCRTR1 (0.89) | HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL27029880 | 0.79 | HCRTR1 (0.75) | HCRTR1HCRTR2CYP1A2 |
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-4310089-A1 | NITROGEN-CONTAINING HETEROCYCLIC POLYCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | Shanghai Hansoh Biomedical Co., Ltd. (CN) | 2024-01-24 | — | — | EP | disclosed |