Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | NMT1 | P30419 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18019531 | 1.00 | TSHR (0.42) | TSHRCA1CA2ENPP2TTR | |
| SCHEMBL257564 | 0.82 | CA2 (0.52) | TSHRCA1CA2ENPP2ERN1 | |
| SCHEMBL177673 | 0.82 | ENPP2 (0.52) | TSHRCA1CA2ENPP2TTR | |
| SCHEMBL29209517 | 0.82 | ENPP2 (0.52) | TSHRCA1CA2ENPP2TTR | |
| SCHEMBL16279878 | 0.82 | CA2 (0.52) | TSHRCA1CA2ENPP2ERN1 | |
| SCHEMBL2144215 | 0.73 | ENPP2 (0.44) | TSHRENPP2TTRERN1 | |
| SCHEMBL16426119 | 0.73 | ENPP2 (0.44) | TSHRCA1CA2ENPP2TTR | |
| SCHEMBL114694 | 0.73 | — | — | |
| SCHEMBL151031 | 0.73 | — | — | |
| SCHEMBL24661957 | 0.71 | ALDH1A1 (0.46) | TSHRCA1CA2ENPP2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118239916-A | Polysubstituted benzo dibenzo five-membered ring compound and application thereof | 烟台显华科技集团股份有限公司 | 2024-06-25 | — | — | CN | disclosed |
| CN-118108574-A | Fluorine-containing compound with trimesic structure and application thereof | 烟台显华科技集团股份有限公司 | 2024-05-31 | — | — | CN | disclosed |