Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.68 |
| ▸ | HTR2A | P28223 | 1/20 | 0.68 |
| ▸ | LTA4H | P09960 | 3/20 | 0.64 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.62 |
| ▸ | HRH2 | P25021 | 1/20 | 0.62 |
| ▸ | HRH1 | P35367 | 1/20 | 0.62 |
| ▸ | MAOB | P27338 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL1583103 | 0.91 | KDM4E (0.69) | KDM4ECYP1A2CYP3A4CYP2D6HTR2A | |
| SCHEMBL13904318 | 0.90 | HRH3 (0.73) | KDM4ECYP1A2CYP3A4CYP2D6HTR2A | |
| Hydrochloric Acid SCHEMBL7407551 | 0.89 | KDM4E (0.67) | KDM4ECYP1A2CYP3A4CYP2D6HTR2A | |
| Hydrochloric Acid SCHEMBL7407548 | 0.89 | KDM4E (0.67) | KDM4ECYP1A2CYP3A4CYP2D6HTR2A | |
| Hydrochloric Acid SCHEMBL7414903 | 0.89 | HRH3 (0.71) | KDM4ECYP1A2CYP3A4CYP2D6HTR2A | |
| SCHEMBL7247226 | 0.84 | HTR2A (0.66) | KDM4ECYP1A2CYP3A4CYP2D6HTR2A | |
| SCHEMBL8806802 | 0.84 | DRD2 (0.65) | KDM4ECYP1A2CYP3A4CYP2D6HTR2A | |
| Hydrochloric Acid SCHEMBL7247113 | 0.83 | HTR2A (0.64) | KDM4ECYP1A2CYP3A4CYP2D6HTR2A | |
| SCHEMBL7139236 | 0.82 | LTA4H (0.89) | KDM4ELTA4HHRH3 | |
| SCHEMBL8805341 | 0.82 | DRD2 (0.62) | HRH3HRH2HRH1MAOB |
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-0751936-A1 | NEW 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES USEFUL AS MEDICAMENTS ACTING ON THE GLUTAMATE RECEPTOR | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-01-08 | — | — | EP | disclosed |
| WO-1995025721-A1 | NEW 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES USEFUL AS MEDICAMENTS ACTING ON THE GLUTAMATE RECEPTOR | SCHERING AKTIENGESELLSCHAFT (DE) | 1995-09-28 | — | — | WO | disclosed |