Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.39 |
| ▸ | POLQ | O75417 | 4/20 | 0.34 |
| ▸ | PDE2A | O00408 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 4/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | RXRB | P28702 | 1/20 | 0.32 |
| ▸ | RXRG | P48443 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL18428342 | 0.76 | PTGS1 (0.35) | CES2PTGS1 | |
| SCHEMBL23206607 | 0.75 | GAA (0.39) | MEN1KMT2AAR | |
| SCHEMBL18428330 | 0.74 | L3MBTL1 (0.38) | CES2MEN1KMT2A | |
| SCHEMBL24727549 | 0.71 | TP53 (0.35) | — | |
| SCHEMBL21757902 | 0.71 | — | — | |
| SCHEMBL21698491 | 0.71 | NOTUM (0.42) | — | |
| SCHEMBL21236875 | 0.70 | CA1 (0.36) | MEN1KMT2A | |
| SCHEMBL21765157 | 0.70 | MEN1 (0.39) | MEN1KMT2A | |
| SCHEMBL24059364 | 0.69 | PDE10A (0.39) | MEN1KMT2ACYP3A4 | |
| SCHEMBL24038361 | 0.69 | RXRA (0.43) | RXRARXRBRXRG |
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-2024147972-A2 | DNA POLYMERASE THETA INHIBITORS CONTAINING NON-SATURATED 5-MEMBERED HETEROCYCLIC RINGS AND USE THEREOF | THOMAS JEFFERSON UNIVERSITY (US) | 2024-07-11 | — | — | WO | disclosed |