Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.38 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31377013 | 1.00 | CASP3 (0.43) | CASP3CYP1A2POLBRPS6KA2ALDH1A1 | |
| SCHEMBL8577340 | 1.00 | CASP3 (0.43) | CASP3CYP1A2POLBRPS6KA2ALDH1A1 | |
| SCHEMBL19533850 | 1.00 | CASP3 (0.43) | CASP3CYP1A2POLBRPS6KA2ALDH1A1 | |
| SCHEMBL30559874 | 1.00 | CASP3 (0.43) | CASP3CYP1A2POLBRPS6KA2ALDH1A1 | |
| SCHEMBL1553885 | 0.81 | CASP3 (0.46) | CASP3CYP1A2POLBALDH1A1CA12 | |
| SCHEMBL19533849 | 0.77 | CYP1A2 (0.42) | CASP3CYP1A2POLBRPS6KA2ALDH1A1 | |
| SCHEMBL28669956 | 0.77 | DRD3 (0.41) | CASP3CYP1A2RPS6KA2ALDH1A1MAPT | |
| SCHEMBL10658088 | 0.77 | ALDH1A1 (0.51) | POLBRPS6KA2ALDH1A1MAPTMEN1 | |
| SCHEMBL10658092 | 0.77 | ALDH1A1 (0.51) | POLBRPS6KA2ALDH1A1MAPTMEN1 | |
| SCHEMBL20954062 | 0.75 | POLB (0.46) | CASP3CYP1A2POLBALDH1A1MAPT |
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-20170226111-A1 | MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS | JANSSEN SCIENCES IRELAND UC (IE) | 2017-08-10 | — | — | US | disclosed |
| WO-1998018833-A1 | POLY(VINYL AMINE) ANALOGS | UNIVERSITY OF MASSACHUSETTS (US) | 1998-05-07 | — | — | WO | 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-20170226111-A1 | MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS | CYP2A7, CYP3A7, HCCS | CASP3 2622/4885CYP1A2 41/4885POLB 2176/4885 |
“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.