Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 6/20 | 0.53 |
| ▸ | TAS2R14 | Q9NYV8 | 3/20 | 0.50 |
| ▸ | DHODH | Q02127 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31268014 | 0.88 | CCR4 (0.51) | CCR4TAS2R14MEN1KMT2AMAPT | |
| SCHEMBL31268017 | 0.83 | CCR4 (0.56) | CCR4HDAC6MEN1KMT2AMAPT | |
| SCHEMBL6182547 | 0.77 | RAB9A (0.54) | CCR4HDAC6MEN1KMT2AMAPT | |
| SCHEMBL29274298 | 0.76 | CCR4 (0.76) | CCR4MEN1KMT2AMAPTGAA | |
| SCHEMBL31267974 | 0.76 | AKR1C3 (0.49) | CCR4TAS2R14MEN1KMT2AMAPT | |
| SCHEMBL4541638 | 0.76 | CCR4 (0.49) | CCR4MEN1KMT2AMAPTGAA | |
| SCHEMBL31268012 | 0.74 | NPC1 (0.66) | MEN1KMT2AMAPTGAACSNK2A1 | |
| SCHEMBL6252872 | 0.74 | RAB9A (0.64) | CCR4MEN1KMT2AMAPTGAA | |
| SCHEMBL6377187 | 0.72 | MAPK1 (0.51) | CCR4MEN1KMT2AMAPTGAA | |
| SCHEMBL11897953 | 0.72 | CCR4 (0.52) | CCR4MEN1KMT2AMAPTGAA |
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-4676475-A1 | HIV-1P ROTEASE INHIBITORS AND USES THEREOF | Purdue Research Foundation (US) | 2026-01-14 | — | — | EP | disclosed |
| WO-2024206093-A1 | HIV-1P ROTEASE INHIBITORS AND USES THEREOF | PURDUE RESEARCH FOUNDATION (US) | 2024-10-03 | — | — | WO | disclosed |