Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 6/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.57 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | DPP4 | P27487 | 7/20 | 0.44 |
| ▸ | DPP7 | Q9UHL4 | 6/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.43 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.42 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.42 |
| ▸ | PREP | P48147 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13221486 | 1.00 | CACNA1B (0.57) | CACNA1BCYP3A4NR1I2CNR1DPP4 | |
| Trifluoroacetic Acid SCHEMBL3035934 | 0.96 | CACNA1B (0.54) | CACNA1BCYP3A4NR1I2CNR1DPP4 | |
| SCHEMBL3256020 | 0.87 | CACNA1B (0.61) | CACNA1BCYP3A4NR1I2CNR1SMYD3 | |
| SCHEMBL13221471 | 0.85 | CACNA1B (0.59) | CACNA1BCYP3A4NR1I2CNR1DPP4 | |
| SCHEMBL3259693 | 0.85 | CACNA1B (0.63) | CACNA1BCYP3A4NR1I2CNR1SMYD3 | |
| SCHEMBL3131708 | 0.84 | CACNA1B (0.58) | CACNA1BCYP3A4NR1I2CNR1DPP4 | |
| Hydrochloric Acid SCHEMBL3031159 | 0.84 | CACNA1B (0.58) | CACNA1BCYP3A4NR1I2CNR1DPP4 | |
| SCHEMBL13221483 | 0.84 | CACNA1B (0.58) | CACNA1BCYP3A4NR1I2CNR1DPP4 | |
| SCHEMBL3259709 | 0.84 | CACNA1B (0.62) | CACNA1BCYP3A4NR1I2CNR1SMYD3 | |
| SCHEMBL13221500 | 0.83 | CACNA1B (0.58) | CACNA1BCYP3A4NR1I2CNR1SMYD3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20130040932-A1 | SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | NEUROMED PHARMACEUTICALS LTD. (CA) | 2013-02-14 | — | — | US | disclosed |
| US-20130040932-A1 | SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | NEUROMED PHARMACEUTICALS LTD. (CA) | 2013-02-14 | — | — | 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-20130040932-A1 | SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | TRPV1, TRPA1, CACNA1D | CACNA1B 23/4885CYP3A4 939/4885NR1I2 765/4885 |
“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.