Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNE1 | P15382 | 1/20 | 0.55 |
| ▸ | CCR1 | P32246 | 1/20 | 0.55 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 1/20 | 0.45 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | SCD | O00767 | 1/20 | 0.41 |
| ▸ | CALCA | P06881 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1151004 | 0.89 | KCNE1 (0.65) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 | |
| Water SCHEMBL20885818 | 0.88 | KCNE1 (0.64) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 | |
| SCHEMBL5314622 | 0.82 | KCNE1 (0.67) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 | |
| SCHEMBL4905094 | 0.80 | KCNE1 (0.65) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 | |
| SCHEMBL13041229 | 0.79 | KCNE1 (0.69) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 | |
| SCHEMBL13302579 | 0.79 | KCNE1 (0.53) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 | |
| Raltegravir SCHEMBL13302573 | 0.79 | KCNE1 (0.83) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 | |
| SCHEMBL1150537 | 0.78 | KCNE1 (0.74) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 | |
| SCHEMBL5315124 | 0.78 | KCNE1 (0.66) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 | |
| SCHEMBL19306601 | 0.78 | KCNE1 (0.75) | KCNE1CCR1KCNQ1SMN1; SMN2ERCC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8318754-B2 | Pyrimidinecarboxamide derivatives | CONCERT PHARMACEUTICALS INC. (US) | 2012-11-27 | — | — | US | disclosed |
| US-20100152214-A1 | NOVEL PYRIMIDINECARBOXAMIDE DERIVATIVES | CONCERT PHARMACEUTICALS INC. (US) | 2010-06-17 | — | — | US | disclosed |
| US-7687509-B2 | Pyrimidinecarboxamide derivatives | CONCERT PHARMACEUTICALS INC. (US) | 2010-03-30 | — | — | US | disclosed |
| US-20090035324-A1 | NOVEL PYRIMIDINECARBOXAMIDE DERIVATIVES | CONCERT PHARMACEUTICALS, INC. (US) | 2009-02-05 | — | — | 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 (2 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-20090035324-A1 | NOVEL PYRIMIDINECARBOXAMIDE DERIVATIVES | TYMP, PNP, DPYD | KCNE1 3599/4885CCR1 2270/4885KCNQ1 3893/4885 |
| US-20100152214-A1 | NOVEL PYRIMIDINECARBOXAMIDE DERIVATIVES | TYMP, PNP, DPYD | KCNE1 3599/4885CCR1 2270/4885KCNQ1 3893/4885 |
“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.