Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13315032 | 0.83 | ALDH1A1 (0.41) | ALDH1A1NPSR1TMEM97SIGMAR1MAPK14 | |
| SCHEMBL10447231 | 0.81 | CA2 (0.41) | ALDH1A1NPSR1GAATMEM97SIGMAR1 | |
| SCHEMBL3543202 | 0.80 | ALDH1A1 (0.45) | ALDH1A1NPSR1TMEM97SIGMAR1MAPK14 | |
| SCHEMBL18498742 | 0.75 | ALDH1A1 (0.46) | ALDH1A1NPSR1TMEM97SIGMAR1MAPK14 | |
| SCHEMBL18498745 | 0.75 | ALDH1A1 (0.46) | ALDH1A1NPSR1TMEM97SIGMAR1MAPK14 | |
| SCHEMBL18498798 | 0.75 | TMEM97 (0.46) | ALDH1A1NPSR1TMEM97SIGMAR1MAPK14 | |
| SCHEMBL3551604 | 0.70 | ALDH1A1 (0.47) | ALDH1A1NPSR1TMEM97SIGMAR1CA2 | |
| SCHEMBL30503761 | 0.69 | ALDH1A1 (0.48) | ALDH1A1NPSR1TMEM97SIGMAR1CA2 | |
| SCHEMBL13232574 | 0.69 | ALDH1A1 (0.47) | ALDH1A1NPSR1TMEM97SIGMAR1KDM4E | |
| SCHEMBL15735798 | 0.68 | ALDH1A1 (0.39) | ALDH1A1NPSR1TMEM97SIGMAR1CA2 |
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-7612200-B2 | Inhibitors of protein kinases | LOCUS PHARMACEUTICALS, INC. (US) | 2009-11-03 | — | — | US | disclosed |
| US-20070185098-A1 | Inhibitors of protein kinases | LOCUS PHARMACEUTICALS, INC. (US) | 2007-08-09 | — | — | 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-20070185098-A1 | Inhibitors of protein kinases | MAP3K20, MAP3K1, MAP3K19 | ALDH1A1 4567/4885NPSR1 2761/4885GAA 2137/4885 |
“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.