Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | SCN1A | P35498 | 2/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.43 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31531384 | 0.90 | CYP1A2 (0.53) | CYP1A2CYP3A4POLBCYP2C19MAPT | |
| SCHEMBL31531342 | 0.89 | CYP3A4 (0.53) | CYP1A2CYP3A4POLBCYP2C19MAPT | |
| SCHEMBL31531341 | 0.88 | CYP1A2 (0.56) | CYP1A2CYP3A4POLBCYP2C19MAPT | |
| SCHEMBL31531251 | 0.88 | CYP1A2 (0.56) | CYP1A2CYP3A4POLBCYP2C19MAPT | |
| SCHEMBL31538484 | 0.86 | CYP1A2 (0.48) | CYP1A2CYP3A4POLBCYP2C19NPC1 | |
| SCHEMBL31531369 | 0.86 | CYP1A2 (0.62) | CYP1A2CYP3A4POLBCYP2C19MAPT | |
| SCHEMBL31531309 | 0.85 | CYP1A2 (0.50) | CYP1A2CYP3A4POLBCYP2C19MAPT | |
| SCHEMBL31538501 | 0.85 | CYP1A2 (0.47) | CYP1A2CYP3A4POLBCYP2C19NPC1 | |
| SCHEMBL31531321 | 0.83 | CYP1A2 (0.51) | CYP1A2CYP3A4POLBCYP2C19MAPT | |
| SCHEMBL31538504 | 0.83 | CYP1A2 (0.45) | CYP1A2CYP3A4POLBCYP2C19SCN1A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025093590-A1 | HETEROARYL ESTER DERIVATIVES AS SODIUM CHANNEL INHIBITORS | CHIESI FARMACEUTICI S.P.A. (IT) | 2025-05-08 | — | — | WO | claimed |