Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 20/20 | 1.00 |
| ▸ | ADORA1 | P30542 | 18/20 | 1.00 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.81 |
| ▸ | TSPO | P30536 | 1/20 | 0.75 |
| ▸ | GPR183 | P32249 | 1/20 | 0.75 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.75 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.75 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL8122971 | 0.92 | ADORA2A (0.85) | ADORA2AADORA1KCNH2TSPOGPR183 | |
| SCHEMBL2814740 | 0.85 | ADORA2A (1.00) | ADORA2AADORA1KCNH2TSPOGPR183 | |
| SCHEMBL29394328 | 0.85 | ADORA2A (1.00) | ADORA2AADORA1KCNH2TSPOGPR183 | |
| SCHEMBL2810379 | 0.84 | ADORA2A (0.77) | ADORA2AADORA1CYP3A4 | |
| SCHEMBL2814736 | 0.83 | ADORA2A (1.00) | ADORA2AADORA1KCNH2CYP3A4 | |
| SCHEMBL2812966 | 0.82 | ADORA2A (0.69) | ADORA2AADORA1KCNH2TSPOGPR183 | |
| SCHEMBL2810157 | 0.80 | ADORA2A (1.00) | ADORA2AADORA1KCNH2CYP3A4 | |
| SCHEMBL2810827 | 0.80 | ADORA2A (0.77) | ADORA2AADORA1KCNH2CYP3A4 | |
| SCHEMBL2814631 | 0.79 | ADORA2A (1.00) | ADORA2AADORA1KCNH2CYP3A4 | |
| SCHEMBL2810804 | 0.78 | ADORA2A (0.64) | ADORA2AADORA1KCNH2TSPOGPR183 |
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-20100249084-A1 | SUBSTITUTED PYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | ALMIRALL, S.A. (ES) | 2010-09-30 | — | — | US | disclosed |
| US-20100249084-A1 | SUBSTITUTED PYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | ALMIRALL, S.A. (ES) | 2010-09-30 | — | — | US | disclosed |
| US-20100249084-A1 | SUBSTITUTED PYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | ALMIRALL, S.A. (ES) | 2010-09-30 | — | — | US | disclosed |
| WO-2008116185-A2 | SUBSTITUTED PYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | NEUROCRINE BIOSCIENCES, INC. (US) | 2008-09-25 | — | — | 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-20100249084-A1 | SUBSTITUTED PYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | ADORA3, ADORA1, ADORA2A | ADORA2A 3/4885ADORA1 2/4885KCNH2 1472/4885 |
“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.