Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11150025 | 0.89 | CYP1A2 (0.54) | CYP1A2CYP2C19NPSR1MAPTALDH1A1 | |
| SCHEMBL11394092 | 0.86 | HDAC3 (0.43) | CYP1A2CYP2C19NPSR1MAPTALDH1A1 | |
| SCHEMBL11379323 | 0.86 | HDAC3 (0.44) | CYP1A2CYP2C19NPSR1MAPTALDH1A1 | |
| SCHEMBL11381130 | 0.82 | ALDH1A1 (0.45) | CYP1A2CYP2C19MAPTALDH1A1MEN1 | |
| SCHEMBL11248037 | 0.82 | HDAC3 (0.43) | CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11377295 | 0.81 | HDAC3 (0.42) | CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2 | |
| Spizofurone SCHEMBL933718 | 0.81 | KDM4E (0.46) | CYP1A2NPSR1MAPTALDH1A1NPC1 | |
| SCHEMBL11248420 | 0.77 | NR3C2 (0.51) | NPSR1NPC1RAB9ASMN1; SMN2HDAC3 | |
| SCHEMBL11155759 | 0.76 | HDAC3 (0.41) | MAPTALDH1A1MEN1NPC1KMT2A | |
| SCHEMBL11903830 | 0.76 | MAPT (0.61) | CYP1A2CYP2C19NPSR1MAPTALDH1A1 |
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-0003084-B1 | SPIROBENZOFURANONE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS MEDICINES | Takeda Chemical Industries, Ltd. (JP) | 1982-02-24 | — | — | EP | disclosed |
| US-4284644-A | Spirobenzofuranone compounds | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1981-08-18 | — | — | US | disclosed |