Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 14/20 | 0.64 |
| ▸ | DRD3 | P35462 | 13/20 | 0.64 |
| ▸ | DRD4 | P21917 | 2/20 | 0.59 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.59 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | HTR7 | P34969 | 1/20 | 0.54 |
| ▸ | HRH1 | P35367 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.54 |
| ▸ | HTR1D | P28221 | 5/20 | 0.51 |
| ▸ | HTR1B | P28222 | 5/20 | 0.51 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.47 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3466653 | 0.86 | DRD2 (0.60) | DRD2DRD3DRD4OPRM1HTR1A | |
| SCHEMBL773073 | 0.82 | DRD2 (0.64) | DRD2DRD3DRD4OPRM1HTR1A | |
| SCHEMBL15756197 | 0.80 | KMT2A (0.55) | DRD2DRD3HTR1AHTR2ASLC6A4 | |
| SCHEMBL3348927 | 0.78 | DRD2 (1.00) | DRD2DRD3DRD4OPRM1HTR1A | |
| SCHEMBL81130 | 0.77 | DRD2 (0.74) | DRD2DRD3DRD4OPRM1HTR1A | |
| SCHEMBL12663322 | 0.77 | DRD2 (0.66) | DRD2DRD3DRD4OPRM1HTR1A | |
| SCHEMBL7844061 | 0.77 | DRD2 (0.74) | DRD2DRD3DRD4OPRM1HTR1A | |
| SCHEMBL3477555 | 0.77 | HDAC3 (0.70) | DRD2DRD3HTR1AHTR2ASLC6A4 | |
| SCHEMBL798065 | 0.76 | HTR5A (0.47) | DRD2DRD3DRD4OPRM1HTR1A | |
| SCHEMBL15942966 | 0.76 | S1PR1 (0.47) | DRD2DRD3HTR1AHTR2ASLC6A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2440554-B1 | PYRAZOLE OXADIAZOLE DERIVATIVES AS S1P1 AGONISTS | MERCK SERONO SA (CH) | 2016-10-05 | — | — | EP | disclosed |
| US-8802663-B2 | Pyrazole oxadiazole derivatives as S1P1 agonists | MERCK SERONO SA (CH) | 2014-08-12 | — | — | US | disclosed |
| US-20120071460-A1 | PYRAZOLE OXADIAZOLE DERIVATIVES AS S1P1 AGONISTS | MERCK SERONO SA (CH) | 2012-03-22 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20120071460-A1 | PYRAZOLE OXADIAZOLE DERIVATIVES AS S1P1 AGONISTS | S1PR1, S1PR3, S1PR2 | DRD2 553/4885DRD3 285/4885DRD4 1375/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.