Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL26867970 | 0.74 | CYP1A2 (0.33) | CYP1A2CYP2C9 | |
| SCHEMBL11527632 | 0.67 | GPX4 (0.42) | — | |
| SCHEMBL2428653 | 0.65 | MLYCD (0.33) | CYP1A2CYP2C9 | |
| SCHEMBL14923174 | 0.65 | CYP1A2 (0.33) | CYP1A2CYP2C9 | |
| SCHEMBL285589 | 0.65 | ALDH1A1 (0.44) | — | |
| SCHEMBL8995000 | 0.64 | TLR8 (0.38) | — | |
| SCHEMBL20843963 | 0.64 | — | — | |
| SCHEMBL8237746 | 0.64 | LMNA (0.44) | CYP1A2CYP2C9 | |
| SCHEMBL15255830 | 0.63 | TLR8 (0.34) | — | |
| SCHEMBL14923170 | 0.63 | CYP1A2 (0.32) | CYP1A2CYP2C9 |
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-2427457-A1 | ISOXAZOLE-PYRIDINE DERIVATIVES AS GABA MODULATORS | F. Hoffmann-La Roche AG (CH) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010127978-A1 | ISOXAZOLE-PYRIDINE DERIVATIVES AS GABA MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-11-11 | — | — | WO | disclosed |