Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.37 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | PPOX | P50336 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 5/20 | 0.33 |
| ▸ | FABP1 | P07148 | 1/20 | 0.32 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3606881 | 0.87 | PTGDR2 (0.39) | ALDH1A1KDM4EHSD17B10PTGDR2PTGDR | |
| SCHEMBL3613668 | 0.85 | PTGDR2 (0.36) | ALDH1A1KDM4EHSD17B10PTGDR2PTGDR | |
| SCHEMBL3605184 | 0.85 | KDM4E (0.43) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL3610789 | 0.85 | KDM4E (0.43) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL3598852 | 0.84 | PTGDR2 (0.37) | ALDH1A1KDM4EHSD17B10PTGDR2PTGDR | |
| SCHEMBL3618213 | 0.84 | TSHR (0.33) | ALDH1A1KDM4EHSD17B10PTGDR2PTGDR | |
| SCHEMBL3601588 | 0.84 | ALDH1A1 (0.42) | ALDH1A1KDM4EHSD17B10PTGDR2PTGDR | |
| SCHEMBL3601096 | 0.83 | PTGDR2 (0.36) | ALDH1A1KDM4EHSD17B10PTGDR2PTGDR | |
| SCHEMBL3610909 | 0.82 | ALDH1A1 (0.41) | ALDH1A1KDM4EHSD17B10PTGDR2HPGD | |
| SCHEMBL3609640 | 0.82 | ALDH1A1 (0.41) | ALDH1A1KDM4EHSD17B10PTGDR2HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100016396-A1 | PYRAZOLE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-01-21 | — | — | 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-20100016396-A1 | PYRAZOLE COMPOUND | SLC5A1, SLC5A2, GLP1R | ALDH1A1 365/4885KDM4E 2049/4885HSD17B10 390/4885 |
“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.