Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | GAA | P10253 | 5/20 | 0.49 |
| ▸ | GLA | P06280 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | CFTR | P13569 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.39 |
| ▸ | CASP7 | P55210 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17603665 | 1.00 | KDM4E (0.49) | KDM4EALDH1A1GAAGLATSHR | |
| SCHEMBL17802090 | 0.81 | ALDH1A1 (0.43) | KDM4EALDH1A1GAAGLATSHR | |
| SCHEMBL16694522 | 0.80 | GAA (0.42) | KDM4EALDH1A1GAAGLATSHR | |
| SCHEMBL31184958 | 0.80 | ATM (0.44) | KDM4EALDH1A1GAAGLATSHR | |
| SCHEMBL21750020 | 0.80 | ATM (0.44) | KDM4EALDH1A1GAAGLATSHR | |
| SCHEMBL9939057 | 0.80 | ATM (0.44) | KDM4EALDH1A1GAAGLATSHR | |
| SCHEMBL30573060 | 0.80 | KDM4E (0.50) | KDM4EALDH1A1GAAGLATSHR | |
| SCHEMBL2003190 | 0.80 | KDM4E (0.50) | KDM4EALDH1A1GAAGLATSHR | |
| SCHEMBL17619233 | 0.79 | SMN1; SMN2 (0.33) | KDM4EALDH1A1GAAGLAKMT2A | |
| SCHEMBL16694957 | 0.79 | SOS1 (0.44) | KDM4EALDH1A1GAAGLATSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-4511114-A1 | HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN | Vertex Pharmaceuticals Incorporated (US) | 2025-02-26 | — | — | EP | disclosed |
| WO-2023205778-A1 | HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-10-26 | — | — | WO | disclosed |