Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 20/20 | 0.60 |
| ▸ | CNR1 | P21554 | 15/20 | 0.60 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL13284753 | 0.91 | CNR2 (0.60) | CNR2CNR1CYP2C8CYP2C19CYP2C9 | |
| SCHEMBL9892045 | 0.86 | CNR2 (0.46) | CNR2CNR1CYP2C8CYP2C19CYP2C9 | |
| SCHEMBL13284764 | 0.85 | CNR2 (0.65) | CNR2CNR1CYP2C8CYP2C19CYP2C9 | |
| SCHEMBL2569083 | 0.78 | CNR2 (0.47) | CNR2CNR1CYP2C8CYP2C19CYP2C9 | |
| SCHEMBL13284543 | 0.77 | CNR2 (0.78) | CNR2CNR1CYP2C8CYP2C19CYP2C9 | |
| SCHEMBL9893093 | 0.77 | CNR2 (0.77) | CNR2CNR1CYP2C8CYP2C19CYP2C9 | |
| SCHEMBL9892068 | 0.75 | CNR2 (1.00) | CNR2CNR1CYP2C8CYP2C19CYP2C9 | |
| SCHEMBL9892070 | 0.75 | CNR2 (1.00) | CNR2CNR1CYP2C8CYP2C19CYP2C9 | |
| SCHEMBL9893098 | 0.75 | CNR2 (1.00) | CNR2CNR1CYP2C8CYP2C19CYP2C9 | |
| SCHEMBL13284777 | 0.75 | CNR2 (0.83) | CNR2CNR1CYP2C8CYP2C19CYP2C9 |
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-2010077836-A2 | PYRROLIDINE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-07-08 | — | — | WO | disclosed |