Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | TUBB1 | Q9H4B7 | 6/20 | 0.34 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28721892 | 0.79 | ALDH1A1 (0.46) | ALDH1A1TSHRTUBB1GLO1LMNA | |
| SCHEMBL17345595 | 0.79 | NPC1 (0.39) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL15989275 | 0.78 | MAPT (0.47) | ALDH1A1TUBB1LMNAMAPTHTT | |
| SCHEMBL4450324 | 0.78 | IRAK4 (0.41) | IRAK4ALDH1A1MAOAMAPT | |
| SCHEMBL28707673 | 0.78 | IRAK4 (0.41) | IRAK4ALDH1A1MAOAMAPT | |
| SCHEMBL6610732 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TSHRTYRLMNAMAPT | |
| SCHEMBL8718534 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TSHRTYRLMNAMAPT | |
| SCHEMBL29268893 | 0.76 | IRAK4 (0.40) | IRAK4ALDH1A1MAOAMAPT | |
| SCHEMBL17345594 | 0.75 | ALDH1A1 (0.43) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL823127 | 0.74 | ALDH1A1 (0.50) | ALDH1A1TSHRNPC1PKMRAB9A |
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-9663475-B2 | 2 amino-3,4-dihydrcquinazoline derivatives and the use thereof as cathepsin D inhibitors | MERCK PATENT GMBH (DE) | 2017-05-30 | — | — | US | disclosed |
| US-20150361053-A1 | 2 AMINO-3,4-DIHYDRCQUINAZOLINE DERIVATIVES AND THE USE THEREOF AS CATHEPSIN D INHIBITORS | MERCK PATENT GMBH (DE) | 2015-12-17 | — | — | 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-20150361053-A1 | 2 AMINO-3,4-DIHYDRCQUINAZOLINE DERIVATIVES AND THE USE THEREOF AS CATHEPSIN D INHIBITORS | CTSD, CTSZ, CTSK | IRAK4 1269/4885ALDH1A1 973/4885TSHR 4711/4885 |
“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.