Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 2/20 | 0.55 |
| ▸ | CCND1 | P24385 | 2/20 | 0.55 |
| ▸ | XDH | P47989 | 2/20 | 0.44 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31074929 | 1.00 | CDK4 (0.55) | CDK4CCND1XDHCA3CA6 | |
| SCHEMBL5708464 | 0.80 | CDK4 (0.59) | CDK4CCND1XDHKDM4EALDH1A1 | |
| SCHEMBL32679861 | 0.80 | CDK4 (0.59) | CDK4CCND1XDHKDM4EALDH1A1 | |
| SCHEMBL5708463 | 0.80 | CDK4 (0.59) | CDK4CCND1XDHKDM4EALDH1A1 | |
| SCHEMBL3720644 | 0.80 | NFE2L2 (0.57) | CDK4CCND1HTR2AHTR2CKCNH2 | |
| SCHEMBL4291385 | 0.80 | NFE2L2 (0.57) | CDK4CCND1HTR2AHTR2CKCNH2 | |
| SCHEMBL2343340 | 0.80 | NFE2L2 (0.57) | CDK4CCND1HTR2AHTR2CKCNH2 | |
| SCHEMBL172942 | 0.79 | TYR (0.52) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL29956453 | 0.79 | TYR (0.52) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL21631066 | 0.77 | CDK4 (0.37) | CDK4CCND1XDHALDH1A1MAPT |
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-4665713-A1 | NEMATICIDAL COMPOUNDS, THEIR COMPOSITION AND USE THEREOF | Bhukhanwala, Komal (IN) | 2025-12-24 | — | — | EP | disclosed |
| WO-2024171230-A1 | NEMATICIDAL COMPOUNDS, THEIR COMPOSITION AND USE THEREOF | BHUKHANWALA KOMAL (IN) | 2024-08-22 | — | — | WO | disclosed |