Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8210656 | 0.80 | CYP2D6 (0.35) | ALDH1A1TSHRNAPRTCYP19A1CYP3A4 | |
| SCHEMBL5865852 | 0.77 | TSHR (0.52) | NR1H2ALDH1A1TSHRNR1I2PTPN1 | |
| SCHEMBL11182253 | 0.74 | NR1H2 (0.33) | NR1H2ALDH1A1RORCNR1H3MAPT | |
| SCHEMBL26657709 | 0.71 | CYP1A2 (0.40) | NR1H2TSHRRORCNR1H3CYP1A2 | |
| SCHEMBL15669154 | 0.71 | KCNN4 (0.35) | ALDH1A1TSHRNAPRTMAPK1 | |
| SCHEMBL788138 | 0.71 | KCNN4 (0.35) | ALDH1A1TSHRNAPRTMAPK1 | |
| SCHEMBL31540877 | 0.71 | HSD11B1 (0.36) | NR1H3 | |
| SCHEMBL31540876 | 0.70 | KDM4E (0.37) | NR1H2ALDH1A1TSHRNR1I2PTPN1 | |
| SCHEMBL27957207 | 0.70 | KCNN4 (0.33) | ALDH1A1TSHRMAPK1 | |
| SCHEMBL2228773 | 0.69 | TSHR (0.48) | NR1H2ALDH1A1TSHRNR1I2PTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025067412-A1 | PREPARATION METHOD FOR ANTI-TUMOR DRUG INTERMEDIATE | 重庆博腾制药科技股份有限公司 | 2025-04-03 | — | — | WO | disclosed |