Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5830984 | 1.00 | ALDH1A1 (0.36) | ALDH1A1ATMHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL20064242 | 0.99 | ALDH1A1 (0.37) | ALDH1A1ATMHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL20495445 | 0.99 | ALDH1A1 (0.37) | ALDH1A1ATMHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL21987398 | 0.91 | ALDH1A1 (0.33) | ALDH1A1ATMHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL26964685 | 0.90 | ALDH1A1 (0.38) | ALDH1A1ATMHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL5831941 | 0.87 | BACE1 (0.36) | CYP3A4HTTSMN1; SMN2BACE1 | |
| SCHEMBL5831935 | 0.87 | BACE1 (0.36) | CYP3A4HTTSMN1; SMN2BACE1 | |
| SCHEMBL5571506 | 0.87 | HSD11B1 (0.37) | ALDH1A1ATMHSD17B10CYP1A2HTT | |
| SCHEMBL5571511 | 0.87 | HSD11B1 (0.37) | ALDH1A1ATMHSD17B10CYP1A2HTT | |
| SCHEMBL5571508 | 0.87 | HSD11B1 (0.37) | ALDH1A1ATMHSD17B10CYP1A2HTT |
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-7115740-B2 | Pyrimido compounds having antiproliferative activity | HOFFMANN-LA ROCHE INC. (US) | 2006-10-03 | — | — | US | disclosed |
| US-20040204427-A1 | Pyrimido compounds having antiproliferative activity | CHEN YI (US) | 2004-10-14 | — | — | 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-20040204427-A1 | Pyrimido compounds having antiproliferative activity | FGFR3, FGFR1, FGFR4 | ALDH1A1 527/4885ATM 536/4885HSD17B10 3029/4885 |
“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.