Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 9/20 | 0.50 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6168219 | 0.93 | HTR6 (0.54) | HTR6NOTUMHTTALDH1A1MEN1 | |
| SCHEMBL6330427 | 0.76 | ALDH1A1 (0.69) | NOTUMHTTALDH1A1MEN1KMT2A | |
| SCHEMBL11478363 | 0.76 | NOTUM (0.58) | NOTUMHTTLMNAHPGDPKM | |
| SCHEMBL4384771 | 0.76 | TP53 (0.59) | NOTUMALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL6167732 | 0.76 | HTR6 (0.65) | HTR6HTTALDH1A1MEN1KMT2A | |
| SCHEMBL17117360 | 0.76 | PKM (0.54) | HTR6NOTUMHTTALDH1A1MEN1 | |
| SCHEMBL1074701 | 0.75 | NOTUM (0.56) | NOTUMHTTALDH1A1LMNAHPGD | |
| Hydrochloric Acid SCHEMBL6330320 | 0.75 | HTR6 (0.64) | HTR6HTTALDH1A1MEN1KMT2A | |
| SCHEMBL6328762 | 0.74 | HTR6 (0.62) | HTR6HTTALDH1A1MEN1KMT2A | |
| SCHEMBL4394801 | 0.74 | ALDH1A1 (0.60) | ALDH1A1MEN1KMT2ALMNAHPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6849644-B2 | Isoquinoline derivatives useful in the treatment of CNS disorders | SMITHKLINE BEECHAM P.L.C. (GB) | 2005-02-01 | — | — | US | disclosed |
| US-20040053956-A1 | Isoquinoline derivatives useful in the treatment of cns disorders | SMITHKLINE BEECHAM P.L.C. (GB) | 2004-03-18 | — | — | US | disclosed |
| EP-1341783-A1 | ISOQUINOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CNS DISORDERS | SMITHKLINE BEECHAM PLC (GB) | 2003-09-10 | — | — | EP | disclosed |
| WO-2002042293-A1 | ISOQUINOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CNS DISORDERS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-05-30 | — | — | 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-20040053956-A1 | Isoquinoline derivatives useful in the treatment of cns disorders | INA, NLN, GRIN2C | HTR6 234/4885NOTUM 3674/4885HTT 160/4885 |
“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.