Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 5/20 | 1.00 |
| ▸ | CYP2C9 | P11712 | 4/20 | 1.00 |
| ▸ | CYP2C19 | P33261 | 4/20 | 1.00 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 5/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | CDC42 | P60953 | 1/20 | 0.33 |
| ▸ | RAC1 | P63000 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2177262 | 0.89 | CYP17A1 (0.80) | CYP17A1CYP2C9CYP2C19SLC6A2SLC6A4 | |
| SCHEMBL12500160 | 0.81 | CYP17A1 (1.00) | CYP17A1CYP2C9CYP2C19SLC6A2SLC6A4 | |
| SCHEMBL14211404 | 0.80 | CYP17A1 (0.74) | CYP17A1CYP2C9CYP2C19SLC6A2SLC6A4 | |
| SCHEMBL14211410 | 0.80 | CYP17A1 (0.70) | CYP17A1CYP2C9CYP2C19SLC6A2SLC6A4 | |
| SCHEMBL9896161 | 0.80 | CYP17A1 (0.67) | CYP17A1CYP2C9CYP2C19CYP19A1AKR1C3 | |
| SCHEMBL2177587 | 0.80 | CYP17A1 (1.00) | CYP17A1CYP2C9CYP2C19SLC6A2SLC6A4 | |
| SCHEMBL10821037 | 0.73 | CYP17A1 (0.57) | CYP17A1CYP2C9CYP2C19SLC6A2SLC6A4 | |
| SCHEMBL16587852 | 0.70 | CYP2C9 (0.59) | CYP17A1CYP2C9CYP2C19AKR1C3AKR1C2 | |
| SCHEMBL16587853 | 0.69 | CYP2C9 (0.52) | CYP17A1CYP2C9CYP2C19AKR1C3AKR1C2 | |
| SCHEMBL9896985 | 0.69 | CYP17A1 (0.53) | CYP17A1CYP2C9CYP2C19CYP19A1AKR1C3 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8987315-B2 | Metalloenzyme inhibitor compounds | INNOCRIN PHARMACEUTICALS, INC. (US) | 2015-03-24 | — | — | US | claimed |
| EP-2519508-B1 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS INC (US) | 2014-07-02 | — | — | EP | claimed |
| US-20120309800-A1 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS, INC. (US) | 2012-12-06 | — | — | US | claimed |
| EP-2519508-A2 | METALLOENZYME INHIBITOR COMPOUNDS | Viamet Pharmaceuticals, Inc. (US) | 2012-11-07 | — | — | EP | claimed |
| WO-2011082245-A2 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS, INC. (US) | 2011-07-07 | — | — | WO | claimed |
| US-8987315-B2 | Metalloenzyme inhibitor compounds | INNOCRIN PHARMACEUTICALS, INC. (US) | 2015-03-24 | — | — | US | disclosed |
| US-8987315-B2 | Metalloenzyme inhibitor compounds | INNOCRIN PHARMACEUTICALS, INC. (US) | 2015-03-24 | — | — | US | disclosed |
| US-8816080-B2 | Four coordinated platinum and palladium complexes with geometrically distorted charge transfer state and their applications in light emitting devices | ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2014-08-26 | — | — | US | disclosed |
| EP-2519508-B1 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS INC (US) | 2014-07-02 | — | — | EP | disclosed |
| US-20120309800-A1 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS, INC. (US) | 2012-12-06 | — | — | US | disclosed |
| EP-2519508-A2 | METALLOENZYME INHIBITOR COMPOUNDS | Viamet Pharmaceuticals, Inc. (US) | 2012-11-07 | — | — | EP | disclosed |
| WO-2011082245-A2 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS, INC. (US) | 2011-07-07 | — | — | 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-20120309800-A1 | METALLOENZYME INHIBITOR COMPOUNDS | MMEL1, GPX1, MPO | CYP17A1 649/4885CYP2C9 840/4885CYP2C19 691/4885 |
“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.