Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | POLQ | O75417 | 6/20 | 0.33 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.32 |
| ▸ | GRK2 | P25098 | 1/20 | 0.32 |
| ▸ | CDK3 | Q00526 | 1/20 | 0.32 |
| ▸ | XPO1 | O14980 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CMA1 | P23946 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29314119 | 0.91 | CRHR1 (0.36) | CRHR1GAANPSR1POLQMEN1 | |
| SCHEMBL29314118 | 0.83 | POLQ (0.33) | GAAPOLQMCOLN3CCNE1GRK2 | |
| SCHEMBL29314123 | 0.82 | ALDH1A1 (0.34) | CRHR1GAANPSR1POLQALDH1A1 | |
| SCHEMBL29314114 | 0.75 | POLQ (0.32) | GAAPOLQMCOLN3ALDH1A1POLB | |
| SCHEMBL29314117 | 0.74 | POLQ (0.31) | POLQ | |
| SCHEMBL29313854 | 0.69 | POLB (0.31) | POLB | |
| SCHEMBL29314307 | 0.67 | GAA (0.32) | GAAPOLQ | |
| SCHEMBL29314469 | 0.65 | CRHR1 (0.38) | CRHR1NPSR1CCNE1GRK2CDK3 | |
| SCHEMBL31009122 | 0.63 | POLQ (0.36) | CRHR1POLQ | |
| SCHEMBL29314125 | 0.63 | SMN1; SMN2 (0.40) | GAANPSR1POLQKDM4EALDH1A1 |
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 |