Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TACR2 | P21452 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL9735159 | 1.00 | KDM5A (0.34) | KDM5AKDM4CKDM5BL3MBTL1TSHR | |
| Hydrochloric Acid SCHEMBL18911747 | 0.81 | DRD2 (0.38) | TSHRSMN1; SMN2ALDH1A1MEN1CYP3A4 | |
| SCHEMBL17001824 | 0.78 | TACR2 (0.39) | TSHRSMN1; SMN2ALDH1A1MEN1CYP3A4 | |
| SCHEMBL16102114 | 0.76 | PARP1 (0.34) | — | |
| SCHEMBL8611209 | 0.76 | ALDH1A1 (0.32) | TSHRALDH1A1MEN1CYP3A4CYP2D6 | |
| SCHEMBL8017905 | 0.72 | TSHR (0.35) | TSHRSMN1; SMN2ALDH1A1MEN1CYP3A4 | |
| SCHEMBL9735107 | 0.70 | HTR3A (0.36) | — | |
| SCHEMBL3920911 | 0.69 | MEN1 (0.33) | TSHRSMN1; SMN2ALDH1A1MEN1CYP3A4 | |
| SCHEMBL1494683 | 0.68 | — | — | |
| SCHEMBL19199720 | 0.67 | SLC6A4 (0.41) | TSHRSMN1; SMN2ALDH1A1MEN1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5091539-A | Reacting an ozolyl cycloalkanone with Grignard reagent or alkali metal compound | SHIONOGI & CO., LTD. (JP) | 1992-02-25 | — | — | US | disclosed |
| EP-0152031-B1 | AZOLYL CYCLOALKANOL DERIVATIVES AND AGRICULTURAL FUNGICIDES | SHIONOGI & CO., LTD. (JP) | 1990-05-09 | — | — | EP | disclosed |
| EP-0152031-A2 | Azolyl cycloalkanol derivatives and agricultural fungicides | SHIONOGI & CO., LTD. (JP) | 1985-08-21 | — | — | EP | disclosed |