Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | CCR8 | P51685 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31107761 | 0.83 | CCR1 (0.47) | CCR1CCR5CCR8ALDH1A1NR4A2 | |
| SCHEMBL31744964 | 0.79 | CCR1 (0.35) | CCR1CCR5CCR8NR4A2HSP90AA1 | |
| SCHEMBL28380296 | 0.77 | NR4A2 (0.33) | ALDH1A1NR4A2KDM4EMEN1KMT2A | |
| SCHEMBL22400550 | 0.76 | KDM4E (0.43) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL14830510 | 0.74 | EPHB4 (0.32) | ALDH1A1NR4A2KDM4EMEN1KMT2A | |
| Formic Acid SCHEMBL31745081 | 0.73 | CCR1 (0.38) | CCR1CCR5CCR8NR4A2KDM4E | |
| SCHEMBL22858221 | 0.73 | KDM4E (0.38) | ALDH1A1NR4A2KDM4EMEN1KMT2A | |
| SCHEMBL30184527 | 0.73 | PDPK1 (0.43) | CCR1CCR5CCR8ALDH1A1KDM4E | |
| SCHEMBL1328750 | 0.73 | PDPK1 (0.43) | CCR1CCR5CCR8ALDH1A1KDM4E | |
| SCHEMBL3624742 | 0.71 | ALDH1A1 (0.50) | CCR1CCR8ALDH1A1NR4A2KDM4E |
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-2024215802-A1 | BENZOFURANYL AND BENZOTHIENYL COMPOUNDS AS P53 MODULATORS | NESTED THERAPEUTICS, INC. (US) | 2024-10-17 | — | — | WO | disclosed |