Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL26091858 | 1.00 | ALDH1A1 (0.46) | ALDH1A1NPSR1KDM4EMAOARAB9A | |
| SCHEMBL7338693 | 0.72 | ALDH1A1 (0.44) | ALDH1A1NPSR1KDM4EMAOAGAA | |
| SCHEMBL26090195 | 0.72 | KDM4E (0.38) | ALDH1A1NPSR1KDM4EMAOARAB9A | |
| SCHEMBL7910374 | 0.66 | — | — | |
| SCHEMBL7910372 | 0.66 | — | — | |
| SCHEMBL20821435 | 0.64 | — | — | |
| SCHEMBL17666902 | 0.63 | — | — | |
| SCHEMBL17666901 | 0.63 | — | — | |
| SCHEMBL11672130 | 0.62 | MAOA (0.42) | ALDH1A1NPSR1KDM4EMAOA | |
| SCHEMBL1642699 | 0.61 | KDM4E (0.52) | NPSR1KDM4EGAAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023067515-A1 | THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2023-04-27 | — | — | WO | disclosed |
| WO-2023067515-A1 | THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2023-04-27 | — | — | WO | disclosed |