Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | KCNJ6 | P48051 | 4/20 | 0.40 |
| ▸ | KCNJ5 | P48544 | 4/20 | 0.40 |
| ▸ | KCNJ3 | P48549 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7537332 | 0.87 | KCNJ6 (0.50) | ALDH1A1L3MBTL1KCNJ6KCNJ5KCNJ3 | |
| SCHEMBL11893853 | 0.85 | ESR1 (0.47) | ALDH1A1L3MBTL1KCNJ6KCNJ5KCNJ3 | |
| SCHEMBL4638471 | 0.82 | MAPK1 (0.40) | ALDH1A1L3MBTL1PARP1SMN1; SMN2MAPK1 | |
| SCHEMBL4639661 | 0.82 | HSD11B1 (0.50) | ALDH1A1PARP1KCNJ6KCNJ5KCNJ3 | |
| SCHEMBL10177915 | 0.81 | L3MBTL1 (0.56) | ALDH1A1L3MBTL1PARP1SMN1; SMN2 | |
| SCHEMBL4639281 | 0.81 | SLC6A2 (0.40) | ALDH1A1KMT2ALMNAMAPK1CA2 | |
| SCHEMBL4639546 | 0.80 | MAPK1 (0.50) | PARP1SMN1; SMN2CYP3A4LMNAMAPK1 | |
| SCHEMBL4638580 | 0.78 | GSTO1 (0.45) | KCNJ6KCNJ3MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL4639725 | 0.75 | L3MBTL1 (0.63) | ALDH1A1L3MBTL1KCNJ6KCNJ5KCNJ3 | |
| SCHEMBL11963454 | 0.74 | LMNA (0.54) | ALDH1A1KMT2ASMN1; SMN2PDE2APDE5A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1773768-A4 | PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | EXELIXIS INC (US) | 2008-08-06 | — | — | EP | claimed |
| EP-1773768-A2 | PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | Exelixis, Inc. (US) | 2007-04-18 | — | — | EP | claimed |
| WO-2006012642-A2 | PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | EXELIXIS, INC. (US) | 2006-02-02 | — | — | WO | claimed |
| US-20080234270-A1 | Pyrrole Derivatives As Pharmaceutical Agents | EXELIXIS, INC. (US) | 2008-09-25 | — | — | 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-20080234270-A1 | Pyrrole Derivatives As Pharmaceutical Agents | PRLHR, PTGDR, TACR1 | ALDH1A1 2251/4885L3MBTL1 4875/4885PARP1 3111/4885 |
“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.