Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8621959 | 0.82 | MAPK1 (0.33) | TDP1GAAHPGDMAPK1 | |
| SCHEMBL6557170 | 0.69 | GAA (0.32) | GAA | |
| SCHEMBL1836217 | 0.68 | — | — | |
| SCHEMBL13940176 | 0.67 | TDP1 (0.66) | TDP1GAAHPGDMAPK1 | |
| SCHEMBL2058604 | 0.67 | — | — | |
| SCHEMBL21295509 | 0.67 | — | — | |
| SCHEMBL538213 | 0.67 | — | — | |
| SCHEMBL22179394 | 0.67 | ABCB11 (0.30) | — | |
| SCHEMBL15658241 | 0.67 | MEN1 (0.31) | — | |
| SCHEMBL1973593 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1472252-A1 | SUBSTITUTED FUSED PYRAZOLECARBOXYLIC ACID ARYLAMIDES AND RELATED COMPOUNDS | Neurogen Corporation (US) | 2004-11-03 | — | — | EP | disclosed |
| WO-2003066634-A1 | SUBSTITUTED FUSED PYRAZOLECARBOXYLIC ACID ARYLAMIDES AND RELATED COMPOUNDS | NEUROGEN CORPORATION (US) | 2003-08-14 | — | — | WO | disclosed |
| EP-1315703-A1 | ARYL SUBSTITUTED TETRAHYDROINDAZOLES AND THEIR USE AS LIGANDS FOR THE GABA-A RECEPTOR | NEUROGEN CORPORATION (US) | 2003-06-04 | — | — | EP | disclosed |
| WO-2002020492-A1 | ARYL SUBSTITUTED TETRAHYDROINDAZOLES AND THEIR USE AS LIGANDS FOR THE GABA-A RECEPTOR | NEUROGEN CORPORATION (US) | 2002-03-14 | — | — | WO | disclosed |