Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 2/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL21345468 | 0.90 | ESR1 (0.35) | ADAMTS5ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL20202064 | 0.84 | ALDH1A1 (0.44) | ADAMTS5ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21345469 | 0.80 | PGR (0.37) | ALDH1A1ESR1PGR | |
| SCHEMBL12723310 | 0.79 | ALDH1A1 (0.37) | ADAMTS5ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2754774 | 0.77 | GAA (0.44) | ADAMTS5ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29776217 | 0.77 | GAA (0.44) | ADAMTS5ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21350687 | 0.76 | PSMB1 (0.36) | ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL18387369 | 0.76 | CNR1 (0.40) | ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17657227 | 0.76 | CNR1 (0.40) | ADAMTS5ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3199631 | 0.76 | EGLN1 (0.36) | ADAMTS5ALDH1A1CYP1A2CYP3A4CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10953369-B2 | Spirocentric compounds and polymers thereof | GEORGIA TECH RESEARCH CORPORATION (US) | 2021-03-23 | — | — | US | disclosed |
| US-20190276454-A1 | Spirocentric Compounds and Polymers Thereof | GEORGIA TECH RESEARCH CORPORATION | 2019-09-12 | — | — | US | disclosed |
| WO-2019173646-A1 | SPIROCENTRIC COMPOUNDS AND POLYMERS THEREOF | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2019-09-12 | — | — | 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 (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-20190276454-A1 | Spirocentric Compounds and Polymers Thereof | PKD1, PKD2, VIM | ADAMTS5 2049/4885ALDH1A1 2886/4885CYP1A2 4805/4885 |
| US-10953369-B2 | Spirocentric compounds and polymers thereof | PKD1, PKD2, VIM | ADAMTS5 2049/4885ALDH1A1 2886/4885CYP1A2 4805/4885 |
“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.