Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.31 |
| ▸ | DRD3 | P35462 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29108228 | 1.00 | KCNH2 (0.34) | KCNH2HRH3CYP2A6LRRK2DRD2 | |
| SCHEMBL29312267 | 0.83 | DRD2 (0.36) | DRD2DRD3 | |
| SCHEMBL511354 | 0.81 | CCNB2 (0.34) | — | |
| SCHEMBL1758550 | 0.78 | KDM4E (0.42) | — | |
| SCHEMBL24323890 | 0.78 | PRMT5 (0.41) | KCNH2HRH3 | |
| SCHEMBL29515354 | 0.78 | PRMT5 (0.41) | KCNH2HRH3 | |
| SCHEMBL31371169 | 0.76 | PRMT5 (0.38) | — | |
| SCHEMBL20400882 | 0.75 | KDM4E (0.51) | — | |
| SCHEMBL23530231 | 0.75 | KDM4E (0.47) | HRH3 | |
| SCHEMBL20400417 | 0.74 | KDM4E (0.54) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117083271-A | Substituted thiadiazolyl derivatives as DNA polymerase theta inhibitors | 伊迪亚生物科学有限公司 | 2023-11-17 | — | — | CN | disclosed |
| EP-4255573-A1 | SUBSTITUTED THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | Ideaya Biosciences, Inc. (US) | 2023-10-11 | — | — | EP | disclosed |
| WO-2022118210-A1 | SUBSTITUTED THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2022-06-09 | — | — | WO | disclosed |