Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | AGXT | P21549 | 1/20 | 0.39 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7717200 | 1.00 | TSHR (0.43) | TSHRIDO1TAAR1SIGMAR1SLC18A2 | |
| SCHEMBL5767822 | 0.85 | RCE1 (0.43) | TSHRIDO1TAAR1MEN1KMT2A | |
| SCHEMBL6719426 | 0.85 | RCE1 (0.43) | TSHRIDO1TAAR1MEN1KMT2A | |
| SCHEMBL6726159 | 0.85 | RCE1 (0.43) | TSHRIDO1TAAR1MEN1KMT2A | |
| SCHEMBL8059584 | 0.83 | ALDH1A1 (0.45) | TSHRMEN1KMT2ARCE1ALDH1A1 | |
| SCHEMBL27509183 | 0.80 | TSHR (0.57) | TSHRIDO1KMT2AAGXTALDH1A1 | |
| SCHEMBL4371522 | 0.79 | TSHR (0.46) | TSHRIDO1TAAR1SIGMAR1SLC18A2 | |
| SCHEMBL201538 | 0.77 | TSHR (0.48) | TSHRIDO1KMT2AAGXTALDH1A1 | |
| SCHEMBL201537 | 0.77 | TSHR (0.48) | TSHRIDO1KMT2AAGXTALDH1A1 | |
| SCHEMBL6731394 | 0.77 | TSHR (0.48) | TSHRIDO1KMT2AAGXTALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020037534-A1 | Combinatorial preparation of a substance library with removal of a zwitterionic compound by precipitation | BASF AKTIENGESELLSCHAFT (DE) | 2002-03-28 | — | — | 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-20020037534-A1 | Combinatorial preparation of a substance library with removal of a zwitterionic compound by precipitation | NEFM, PSPH, NGLY1 | TSHR 3420/4885IDO1 3207/4885TAAR1 2367/4885 |
“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.