Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP2 | P42575 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 6/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | RAD52 | P43351 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MDH1 | P40925 | 1/20 | 0.34 |
| ▸ | MDH2 | P40926 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21769975 | 0.94 | CASP2 (0.36) | CASP2MEN1KMT2ARAB9ALMNA | |
| SCHEMBL21752971 | 0.90 | MEN1 (0.40) | CASP2MEN1KMT2ARAB9ALMNA | |
| SCHEMBL21769895 | 0.84 | LMNA (0.35) | CASP2MEN1KMT2ARAB9ALMNA | |
| SCHEMBL21753070 | 0.82 | LMNA (0.34) | CASP2MEN1KMT2ARAB9ALMNA | |
| SCHEMBL21752924 | 0.81 | MEN1 (0.44) | CASP2MEN1KMT2ARAB9ALMNA | |
| SCHEMBL21769893 | 0.78 | LMNA (0.33) | CASP2MEN1KMT2ARAB9ALMNA | |
| SCHEMBL21752969 | 0.78 | MEN1 (0.40) | CASP2MEN1KMT2ARAB9ALMNA | |
| SCHEMBL27845478 | 0.75 | LMNA (0.61) | CASP2MEN1KMT2ARAB9ALMNA | |
| SCHEMBL21769896 | 0.72 | MEN1 (0.35) | CASP2MEN1KMT2ARAB9ALMNA | |
| SCHEMBL16216731 | 0.71 | LMNA (0.52) | CASP2MEN1KMT2ARAB9ALMNA |
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-3840834-A2 | AROMATIC MOLECULES FOR USE IN THE TREATMENT OF PATHOLOGICAL CONDITIONS | Xeniopro GmbH (DE) | 2021-06-30 | — | — | EP | disclosed |
| WO-2020039088-A2 | NOVEL COMPOUNDS | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |