Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLQ | O75417 | 2/20 | 0.38 |
| ▸ | TACR1 | P25103 | 7/20 | 0.33 |
| ▸ | TACR2 | P21452 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.30 |
| ▸ | LIPE | Q05469 | 2/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL29313703 | 0.93 | TACR1 (0.39) | POLQTACR1TACR2SLC6A4 | |
| SCHEMBL29313707 | 0.91 | TACR1 (0.39) | POLQTACR1TACR2CYP3A4CYP2C9 | |
| SCHEMBL29313711 | 0.90 | TACR1 (0.36) | POLQTACR1SLC6A4 | |
| SCHEMBL29313695 | 0.87 | POLQ (0.37) | POLQ | |
| SCHEMBL29313712 | 0.86 | POLQ (0.35) | POLQTACR1TACR2SLC6A4 | |
| SCHEMBL29313696 | 0.86 | POLQ (0.36) | POLQTACR1 | |
| SCHEMBL29313743 | 0.85 | POLQ (0.35) | POLQ | |
| SCHEMBL29313746 | 0.85 | POLQ (0.35) | POLQ | |
| SCHEMBL29313670 | 0.84 | POLQ (0.35) | POLQTACR1TACR2 | |
| SCHEMBL29313609 | 0.82 | POLQ (0.40) | POLQLIPE |
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 |