Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | PTGIR | P43119 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL13966698 | 0.90 | ALDH1A1 (0.41) | ALDH1A1TDP1TSHRTHRBPTGIR | |
| SCHEMBL12332427 | 0.89 | ALDH1A1 (0.47) | ALDH1A1TDP1TSHRTHRBPTGIR | |
| SCHEMBL13976282 | 0.88 | ALDH1A1 (0.42) | ALDH1A1TSHRTHRBPTGIR | |
| SCHEMBL13966739 | 0.88 | ALDH1A1 (0.46) | ALDH1A1TSHRTHRBPTGIRKMT2A | |
| SCHEMBL11509860 | 0.86 | THRB (0.46) | ALDH1A1TDP1TSHRTHRBALOX15 | |
| SCHEMBL496421 | 0.85 | ALDH1A1 (0.60) | ALDH1A1TDP1TSHRTHRBPTGIR | |
| SCHEMBL12269715 | 0.85 | ALDH1A1 (0.60) | ALDH1A1TDP1TSHRTHRBPTGIR | |
| SCHEMBL5072182 | 0.85 | TDP1 (0.50) | ALDH1A1TDP1PTGIRNPC1RAB9A | |
| SCHEMBL12332372 | 0.84 | ALDH1A1 (0.49) | ALDH1A1TDP1TSHRTHRBKMT2A | |
| SCHEMBL12975815 | 0.80 | ALDH1A1 (0.55) | ALDH1A1TDP1TSHRTHRBKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-9511004-B2 | Dental material, dental material composition, dental restorative material, and cured product | MITSUI CHEMICALS, INC. (JP) | 2016-12-06 | — | — | US | disclosed |
| US-9504632-B2 | Compound, composition comprising the compound and cured product | MITSUI CHEMICALS, INC. (JP) | 2016-11-29 | — | — | US | disclosed |
| US-20120296003-A1 | DENTAL MATERIAL, DENTAL MATERIAL COMPOSITION, DENTAL RESTORATIVE MATERIAL, AND CURED PRODUCT | MITSUI CHEMICALS, INC (JP) | 2012-11-22 | — | — | US | disclosed |
| US-20120296061-A1 | NOVEL COMPOUND, COMPOSITION COMPRISING THE COMPOUND AND CURED PRODUCT | MITSUI CHEMICALS, INC. (JP) | 2012-11-22 | — | — | 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 (2 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-20120296061-A1 | NOVEL COMPOUND, COMPOSITION COMPRISING THE COMPOUND AND CURED PRODUCT | GGPS1, FDFT1, FDPS | ALDH1A1 916/4885TDP1 4518/4885TSHR 4869/4885 |
| US-20120296003-A1 | DENTAL MATERIAL, DENTAL MATERIAL COMPOSITION, DENTAL RESTORATIVE MATERIAL, AND CURED PRODUCT | CAD, SEM1, REV1 | ALDH1A1 181/4885TDP1 807/4885TSHR 4854/4885 |
“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.