Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 5/20 | 0.55 |
| ▸ | PPARA | Q07869 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | SCN4A | P35499 | 2/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1305299 | 0.83 | PPARA (0.58) | PPARGPPARAMEN1KMT2AALDH1A1 | |
| SCHEMBL21895800 | 0.83 | PPARA (0.58) | PPARGPPARAMEN1KMT2AALDH1A1 | |
| SCHEMBL28619870 | 0.83 | PPARA (0.58) | PPARGPPARAMEN1KMT2AALDH1A1 | |
| Water SCHEMBL11798405 | 0.81 | PPARA (0.56) | PPARGPPARAMEN1KMT2AALDH1A1 | |
| SCHEMBL21991335 | 0.80 | PPARA (0.55) | PPARGPPARAMEN1KMT2AALDH1A1 | |
| SCHEMBL12365663 | 0.80 | MAPT (0.58) | MEN1KMT2AALDH1A1RAB9AMAPK1 | |
| SCHEMBL11536518 | 0.79 | PPARA (0.54) | PPARGPPARAMEN1KMT2AALDH1A1 | |
| SCHEMBL1548918 | 0.77 | PPARG (0.59) | PPARGPPARAMEN1KMT2AALDH1A1 | |
| SCHEMBL7080512 | 0.77 | PPARA (0.44) | PPARGPPARAMEN1KMT2AALDH1A1 | |
| SCHEMBL7078220 | 0.77 | MEN1 (0.45) | PPARGPPARAMEN1KMT2AALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113979907-A | Cyclohexane-1, 3-dione compound and application thereof | 郑州恒诚仪器耗材有限公司 | 2022-01-28 | — | — | CN | disclosed |
| CN-111205208-B | Cyclohexane-1, 3-diketone compound and synthetic method and application thereof | 郑州恒诚仪器耗材有限公司 | 2021-12-17 | — | — | CN | disclosed |
| CN-111205208-A | Cyclohexane-1, 3-diketone compound and synthetic method and application thereof | 郑州手性药物研究院有限公司 | 2020-05-29 | — | — | CN | disclosed |