Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 9/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3876436 | 1.00 | SMO (0.41) | SMOTRPV1CYP1A2CYP2D6GSK3B | |
| SCHEMBL13761506 | 0.92 | TRPV1 (0.38) | SMOTRPV1DGAT1 | |
| SCHEMBL3887740 | 0.92 | TRPV1 (0.38) | SMOTRPV1DGAT1 | |
| SCHEMBL3885538 | 0.91 | MALT1 (0.40) | SMOTRPV1 | |
| SCHEMBL3879468 | 0.91 | TRPV1 (0.38) | SMOTRPV1 | |
| SCHEMBL3884028 | 0.91 | MALT1 (0.40) | SMOTRPV1 | |
| SCHEMBL13761549 | 0.91 | MALT1 (0.40) | SMOTRPV1 | |
| SCHEMBL3889401 | 0.90 | TRPV1 (0.40) | SMOTRPV1DGAT1 | |
| SCHEMBL3991603 | 0.89 | HSD17B10 (0.43) | SMOTRPV1CYP1A2CYP2D6GSK3B | |
| SCHEMBL13761561 | 0.88 | SYK (0.41) | SMOTRPV1CYP1A2CYP2D6GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |
| US-20070027155-A1 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION | 2007-02-01 | — | — | US | disclosed |
| CN-1823057-A | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORP (US) | 2006-08-23 | — | — | CN | 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-20070027155-A1 | Biaryl piperazinyl-pyridine analogues | GPR174, GPR68, PPARG | SMO 1465/4885TRPV1 244/4885CYP1A2 405/4885 |
“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.