Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PER2 | O15055 | 2/20 | 0.44 |
| ▸ | CRY1 | Q16526 | 2/20 | 0.44 |
| ▸ | CRY2 | Q49AN0 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | APLNR | P35414 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | RORA | P35398 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | RORB | Q92753 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18186635 | 0.84 | TSHR (0.47) | SMN1; SMN2CA2KMT2ATSHRCA1 | |
| SCHEMBL11033646 | 0.82 | TSHR (0.41) | SMN1; SMN2CA2MEN1MAPTKMT2A | |
| SCHEMBL25486668 | 0.80 | TSHR (0.42) | SMN1; SMN2CA2KMT2ATSHRCA1 | |
| SCHEMBL25389273 | 0.80 | CRY1 (0.46) | PER2CRY1CRY2SMN1; SMN2ALDH1A1 | |
| SCHEMBL16757114 | 0.76 | TDP1 (0.39) | CA2MEN1MAPTKMT2ATSHR | |
| SCHEMBL10689073 | 0.75 | TSHR (0.47) | SMN1; SMN2CA2KMT2ATSHRCA1 | |
| SCHEMBL6654165 | 0.75 | TSHR (0.47) | SMN1; SMN2CA2KMT2ATSHRCA1 | |
| SCHEMBL16756891 | 0.75 | CA1 (0.40) | CA2KMT2ATSHRCA1CA4 | |
| SCHEMBL17796108 | 0.74 | TSHR (0.45) | SMN1; SMN2CA2KMT2ATSHRCA1 | |
| SCHEMBL17796120 | 0.74 | TSHR (0.45) | SMN1; SMN2CA2KMT2ATSHRCA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4251623-A1 | ARYLOXAZOLO SPIRAL RING DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION | F. Hoffmann-La Roche AG (CH) | 2023-10-04 | — | — | EP | disclosed |
| CN-116457352-A | Aryloxazolo spiro derivatives for the treatment and prophylaxis of hepatitis b virus infection | 豪夫迈·罗氏有限公司 | 2023-07-18 | — | — | CN | disclosed |
| WO-2022112140-A1 | ARYLOXAZOLO SPIRAL RING DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION | F. HOFFMANN-LA ROCHE AG (CH) | 2022-06-02 | — | — | WO | disclosed |