Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3330685 | 0.82 | GPR119 (0.46) | TDP1ADORA2AADORA2BALDH1A1KDM4E | |
| SCHEMBL8950068 | 0.81 | DGAT1 (0.46) | TDP1ADORA2AADORA2BALDH1A1KDM4E | |
| SCHEMBL19329069 | 0.79 | ALDH1A1 (0.45) | TDP1ADORA2AADORA2BALDH1A1KDM4E | |
| SCHEMBL7845741 | 0.75 | SMN1; SMN2 (0.56) | TDP1ADORA2AADORA2BALDH1A1KDM4E | |
| SCHEMBL22530210 | 0.74 | HDAC1 (0.40) | TDP1ADORA2AADORA2BALDH1A1KDM4E | |
| SCHEMBL24369883 | 0.74 | CYP11B2 (0.51) | TDP1ADORA2AADORA2BALDH1A1KDM4E | |
| SCHEMBL17130196 | 0.74 | MAPT (0.35) | ADORA2AALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL8808172 | 0.73 | CD274 (0.52) | TDP1ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL19387238 | 0.73 | CA1 (0.70) | TDP1ALDH1A1KDM4EMAPTCA1 | |
| Biphenyl Dimethyl Dicarboxylate SCHEMBL68521 | 0.73 | CA1 (0.70) | TDP1ALDH1A1KDM4EMAPTCA1 |
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-8188085-B2 | Antifungal agents | MERCK SHARP & DOHME CORP. (US) | 2012-05-29 | — | — | US | disclosed |
| US-20100113439-A1 | Antifungal agents | MERCK & CO., INC. (US) | 2010-05-06 | — | — | 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-20100113439-A1 | Antifungal agents | GMDS, GBA3, UGGT1 | TDP1 541/4885ADORA2A 2041/4885ADORA2B 3263/4885 |
“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.