Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | GCGR | P47871 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.33 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22819242 | 0.84 | BACE2 (0.42) | BACE2HRH4PGRPDK1PDK2 | |
| SCHEMBL224235 | 0.78 | HRH4 (0.49) | BACE2HRH4KDM4EALDH1A1GAA | |
| SCHEMBL5801365 | 0.78 | PGR (0.50) | BACE2HRH4PGRKDM4EPDK1 | |
| SCHEMBL4398648 | 0.78 | PDK1 (0.45) | BACE2HRH4PGRALDH1A1PDK1 | |
| SCHEMBL28194011 | 0.76 | HRH4 (0.41) | BACE2HRH4PDK2TRPA1SCN5A | |
| SCHEMBL3644863 | 0.75 | APP (0.44) | HRH4PDK2TRPA1SCN5ASCN9A | |
| SCHEMBL20786844 | 0.75 | CNR2 (0.48) | KDM4EALDH1A1GAA | |
| SCHEMBL2312436 | 0.75 | HRH4 (0.43) | BACE2HRH4PGRKDM4EALDH1A1 | |
| SCHEMBL1038946 | 0.75 | HRH4 (0.41) | BACE2HRH4PDK2TRPA1SCN5A | |
| SCHEMBL352769 | 0.75 | SLC22A12 (0.41) | HRH4PDK1PDK2PDK3PDK4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2981538-B1 | PIPERAZINO[1,2-A]INDOL-1-ONES AND [1,4]DIAZEPINO[1,2-A]INDOL-1-ONE | HOFFMANN LA ROCHE (CH) | 2017-08-02 | — | — | EP | disclosed |
| US-9586966-B2 | Piperazino[1,2-a]indol-1-ones and [1,4]diazepino[1,2-a]indol-one | HOFFMANN-LA ROCHE INC. (US) | 2017-03-07 | — | — | US | disclosed |
| EP-2981538-A1 | PIPERAZINO[1,2-A]INDOL-1-ONES AND [1,4]DIAZEPINO[1,2-A]INDOL-1-ONE | F. Hoffmann-La Roche AG (CH) | 2016-02-10 | — | — | EP | disclosed |
| US-20160016963-A1 | Piperazino[1,2-a]indol-1-ones and [1,4]diazepino[1,2-a]indol-one | HOFFMANN-LA ROCHE INC. (US) | 2016-01-21 | — | — | US | disclosed |
| CN-105246895-A | Piperazino [1, 2-a ] indol-1-ones and [1, 4] diaza-o [1, 2-a ] indol-1-ones | HOFFMANN LA ROCHE | 2016-01-13 | — | — | CN | disclosed |
| WO-2014161801-A1 | PIPERAZINO[1,2-A]INDOL-1-ONES AND [1,4]DIAZEPINO[1,2-A]INDOL-1-ONE | F. HOFFMANN-LA ROCHE AG (CH) | 2014-10-09 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20160016963-A1 | Piperazino[1,2-a]indol-1-ones and [1,4]diazepino[1,2-a]indol-one | DRD3, HTR3C, HTR1D | BACE2 404/4885HRH4 1406/4885PGR 3098/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.