Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 2/20 | 0.55 |
| ▸ | IMPDH1 | P20839 | 2/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.45 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.45 |
| ▸ | ITGAL | P20701 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | AHR | P35869 | 1/20 | 0.45 |
| ▸ | ADK | P55263 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 2/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL733659 | 0.84 | SLC6A4 (0.52) | ATMSLC6A4HTR1AHTR6DRD1 | |
| SCHEMBL29994158 | 0.84 | SLC6A4 (0.52) | ATMSLC6A4HTR1AHTR6DRD1 | |
| Indole SCHEMBL9436374 | 0.80 | ATM (0.71) | IMPDH2IMPDH1ATMTRPA1CA1 | |
| Indole SCHEMBL1821121 | 0.80 | ATM (0.71) | IMPDH2IMPDH1ATMTRPA1CA1 | |
| SCHEMBL5931727 | 0.78 | IMPDH2 (0.67) | IMPDH2IMPDH1TRPA1CA1CA2 | |
| Indole SCHEMBL7941445 | 0.78 | ATM (0.69) | IMPDH2IMPDH1ATMTRPA1CA1 | |
| SCHEMBL91366 | 0.73 | IMPDH2 (1.00) | IMPDH2IMPDH1AHRSLC6A4SLC6A2 | |
| SCHEMBL30389000 | 0.73 | IMPDH2 (1.00) | IMPDH2IMPDH1AHRSLC6A4SLC6A2 | |
| SCHEMBL20846158 | 0.72 | HTR6 (0.51) | SLC6A4DRD2DRD4DRD3HTR6 | |
| SCHEMBL12377872 | 0.72 | SLC6A4 (0.48) | IMPDH2IMPDH1ATMSLC6A4HTR6 |
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 |
|---|---|---|---|---|---|---|---|
| US-8138187-B2 | Substituted heteroaryl derivatives | GRUENENTHAL GMBH (DE) | 2012-03-20 | — | — | US | disclosed |
| US-20100009986-A1 | SUBSTITUTED HETEROARYL DERIVATIVES | GRUNENTHAL GMBH (DE) | 2010-01-14 | — | — | US | 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-20100009986-A1 | SUBSTITUTED HETEROARYL DERIVATIVES | CYP3A43, HMGCR, ABCG2 | IMPDH2 2708/4885IMPDH1 3288/4885ATM 3652/4885 |
“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.