Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPC5 | Q9UL62 | 6/20 | 0.51 |
| ▸ | TRPC4 | Q9UBN4 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | TRPC1 | P48995 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31042858 | 0.91 | TRPC5 (0.51) | TRPC5TRPC4KCNH2TRPC1TP53 | |
| SCHEMBL31042856 | 0.91 | TRPC5 (0.53) | TRPC5TRPC4KCNH2TRPC1TP53 | |
| SCHEMBL31042922 | 0.90 | TRPC5 (0.56) | TRPC5TRPC4KCNH2TRPC1TP53 | |
| SCHEMBL31042905 | 0.89 | TRPC5 (0.52) | TRPC5TRPC4KCNH2TRPC1TP53 | |
| SCHEMBL31042893 | 0.88 | TRPC5 (0.51) | TRPC5TRPC4KCNH2TRPC1TP53 | |
| SCHEMBL31042900 | 0.88 | TRPC5 (0.53) | TRPC5TRPC4KCNH2TRPC1TP53 | |
| SCHEMBL31042884 | 0.88 | TRPC5 (0.55) | TRPC5TRPC4KCNH2TRPC1TP53 | |
| SCHEMBL31042852 | 0.88 | TRPC5 (0.51) | TRPC5TRPC4KCNH2TRPC1TP53 | |
| SCHEMBL31042908 | 0.87 | TRPC5 (0.55) | TRPC5TRPC4KCNH2TRPC1TP53 | |
| SCHEMBL31042921 | 0.87 | TRPC5 (0.52) | TRPC5TRPC4KCNH2TRPC1TP53 |
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-4663640-A1 | XANTHINE COMPOUND AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2025-12-17 | — | — | EP | disclosed |
| WO-2024164818-A1 | XANTHINE COMPOUND AND USE THEREOF | 中国科学院上海药物研究所 | 2024-08-15 | — | — | WO | disclosed |
| CN-118459461-A | Xanthine compound and application thereof | 中国科学院上海药物研究所 | 2024-08-09 | — | — | CN | disclosed |