Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
| ▸ | FKBP1A | P62942 | 4/20 | 0.62 |
| ▸ | HTT | P42858 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL4387896 | 0.81 | ALDH1A1 (0.58) | ALDH1A1KDM4EFKBP1AHTTSMN1; SMN2 | |
| SCHEMBL5066426 | 0.81 | CCR1 (0.61) | ALDH1A1KDM4EHTTSMN1; SMN2HPGD | |
| SCHEMBL12988518 | 0.81 | FKBP1A (0.71) | ALDH1A1KDM4EFKBP1ASMN1; SMN2TSHR | |
| SCHEMBL6261713 | 0.81 | KDM4E (0.79) | ALDH1A1KDM4EFKBP1AHTTSMN1; SMN2 | |
| SCHEMBL4911164 | 0.79 | KDM4E (0.56) | ALDH1A1KDM4ETDP1FKBP1AHTT | |
| SCHEMBL367867 | 0.77 | TSHR (0.63) | ALDH1A1KDM4EFKBP1AHTTSMN1; SMN2 | |
| SCHEMBL22633493 | 0.76 | CPT2 (0.56) | ALDH1A1KDM4EFKBP1AHTTSMN1; SMN2 | |
| SCHEMBL1294980 | 0.76 | ALDH1A1 (0.71) | ALDH1A1KDM4EFKBP1AHTTSMN1; SMN2 | |
| SCHEMBL5671909 | 0.76 | HSD11B1 (0.56) | ALDH1A1TDP1HTTSMN1; SMN2HPGD | |
| SCHEMBL6441529 | 0.76 | EPHX2 (0.54) | ALDH1A1FKBP1AHTTSMN1; SMN2HPGD |
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-20050176733-A1 | Chk-1 inhibitors | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2005-08-11 | — | — | US | disclosed |
| WO-2005072733-A1 | DYARYLUREA COMPOUNDS AS CHK-1 INHIBITORS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2005-08-11 | — | — | 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-20050176733-A1 | Chk-1 inhibitors | CHEK1, CHEK2, CHKA | ALDH1A1 3770/4885KDM4E 955/4885TDP1 262/4885 |
“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.