Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CNR2 | P34972 | 3/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | RORC | P51449 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL15646125 | 0.92 | NAMPT (0.55) | CYP3A4CYP2C19CYP2C9CNR2POLB | |
| SCHEMBL15646163 | 0.92 | LMNA (0.53) | CYP3A4CYP2C19CYP2C9CYP2D6CNR2 | |
| SCHEMBL12542847 | 0.89 | CNR2 (0.46) | CYP3A4CYP2C19CYP2C9CYP2D6CNR2 | |
| SCHEMBL15646405 | 0.88 | NAMPT (0.51) | CYP3A4CYP2C19CYP2C9CYP2D6CNR2 | |
| SCHEMBL15681442 | 0.87 | EPHX2 (0.47) | CYP3A4CYP2C19CYP2C9CYP2D6CNR2 | |
| SCHEMBL15645772 | 0.85 | CNR2 (0.54) | CYP3A4CYP2C19CYP2C9CYP2D6CNR2 | |
| SCHEMBL15646151 | 0.82 | CNR2 (0.51) | CYP3A4CYP2C19CYP2C9CYP2D6CNR2 | |
| SCHEMBL5019854 | 0.82 | CNR2 (0.51) | CYP3A4CYP2C19CYP2C9CYP2D6CNR2 | |
| SCHEMBL15646189 | 0.82 | TP53 (0.47) | CYP3A4CYP2C19CYP2C9CYP2D6CNR2 | |
| SCHEMBL15647582 | 0.82 | CYP3A4 (0.48) | CYP3A4CYP2C19CYP2C9CYP2D6CNR2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140113898-A1 | BISARYLSULFONE AND DIALKYLARYLSULFONE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | ZALICUS PHARMACEUTICALS LTD. (US) | 2014-04-24 | — | — | 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-20140113898-A1 | BISARYLSULFONE AND DIALKYLARYLSULFONE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | CACNA1C, CACNA1S, KCNN4 | CYP3A4 322/4885CYP2C19 357/4885CYP2C9 219/4885 |
“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.