Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | BCHE | P06276 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | SCN1A | P35498 | 2/20 | 0.49 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.49 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8555949 | 0.99 | SIGMAR1 (0.54) | SIGMAR1MAPK1BCHEHTTSCN1A | |
| SCHEMBL8550623 | 0.89 | BCHE (0.48) | SIGMAR1MAPK1BCHE | |
| Hydrochloric Acid SCHEMBL8551753 | 0.88 | BCHE (0.47) | SIGMAR1MAPK1BCHE | |
| SCHEMBL8553874 | 0.87 | BCHE (0.48) | SIGMAR1MAPK1BCHE | |
| Hydrochloric Acid SCHEMBL8551803 | 0.86 | BCHE (0.47) | SIGMAR1MAPK1BCHE | |
| SCHEMBL8550733 | 0.85 | MAPK1 (0.61) | SIGMAR1MAPK1BCHE | |
| Hydrochloric Acid SCHEMBL8554803 | 0.84 | MAPK1 (0.60) | SIGMAR1MAPK1BCHE | |
| SCHEMBL8551865 | 0.82 | BCHE (0.60) | SIGMAR1BCHESCN1ASCN2ASCN3A | |
| SCHEMBL8551099 | 0.81 | MAPT (0.66) | SIGMAR1BCHE | |
| SCHEMBL8551176 | 0.81 | PGR (0.54) | SIGMAR1MAPK1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1084329-C | Benzyl piepridine derivs as pharmaceutical agents | HOFFMANN LA ROCHE (CH) | 2002-05-08 | — | — | CN | disclosed |
| EP-0871613-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 1998-10-21 | — | — | EP | disclosed |
| CN-1183768-A | Benzyl piepridine derivs as pharmaceutical agents | HOFFMANN LA ROCHE (CH) | 1998-06-03 | — | — | CN | disclosed |
| US-5753679-A | SCIZOPHRENIA | HOFFMANN-LA ROCHE INC. (US) | 1998-05-19 | — | — | US | disclosed |
| WO-1996035666-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 1996-11-14 | — | — | WO | disclosed |