Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.44 |
| ▸ | CTSS | P25774 | 4/20 | 0.44 |
| ▸ | CTSK | P43235 | 4/20 | 0.44 |
| ▸ | NAMPT | P43490 | 2/20 | 0.44 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8007420 | 0.86 | CYP17A1 (0.60) | CYP17A1DRD2PTGDR2MAPK14PTPN11 | |
| SCHEMBL4132208 | 0.85 | CYP17A1 (0.56) | CYP17A1DRD2PTGDR2MAPK14PTPN11 | |
| SCHEMBL16946760 | 0.83 | CYP17A1 (0.50) | CYP17A1DRD2PTGDR2MAPK14PTPN11 | |
| SCHEMBL1368399 | 0.83 | AURKA (0.47) | CYP17A1NPC1LMNAMAPTHTT | |
| SCHEMBL4171524 | 0.83 | CYP17A1 (0.51) | CYP17A1NPC1RAB9ADRD2PTGDR2 | |
| SCHEMBL132701 | 0.82 | CYP17A1 (0.76) | CYP17A1DRD2PTGDR2MAPK14PTPN11 | |
| SCHEMBL13055402 | 0.82 | CYP17A1 (0.59) | CYP17A1DRD2PTGDR2MAPK14ALDH1A1 | |
| SCHEMBL23336325 | 0.81 | CYP17A1 (0.62) | CYP17A1MAPTDRD2PTGDR2MAPK14 | |
| SCHEMBL17378103 | 0.81 | KCNQ4 (0.50) | CYP17A1NPC1THRBRAB9ANR1H2 | |
| SCHEMBL10361607 | 0.81 | CYP17A1 (0.61) | CYP17A1RAB9ALMNADRD2PTGDR2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015162536-A1 | NOVEL PROCESS FOR PREPARATION OF MIRABEGRON AND IT'S INTERMEDIATE | CALYX CHEMICALS AND PHARMACEUTICALS LTD. (IN) | 2015-10-29 | — | — | WO | claimed |
| US-20210387954-A1 | OXADIAZOLES AS FUNGICIDES | PI INDUSTRIES LIMITED (IN) | 2021-12-16 | — | — | US | disclosed |
| WO-2020070611-A1 | OXADIAZOLES AS FUNGICIDES | PI INDUSTRIES LTD (IN) | 2020-04-09 | — | — | WO | disclosed |
| WO-2015162536-A1 | NOVEL PROCESS FOR PREPARATION OF MIRABEGRON AND IT'S INTERMEDIATE | CALYX CHEMICALS AND PHARMACEUTICALS LTD. (IN) | 2015-10-29 | — | — | WO | disclosed |
| WO-2015162536-A1 | NOVEL PROCESS FOR PREPARATION OF MIRABEGRON AND IT'S INTERMEDIATE | CALYX CHEMICALS AND PHARMACEUTICALS LTD. (IN) | 2015-10-29 | — | — | WO | disclosed |
| US-8461329-B2 | Isoquinoline derivative | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2013-06-11 | — | — | US | disclosed |
| US-20110288293-A1 | ISOQUINOLINE DERIVATIVE | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2011-11-24 | — | — | US | disclosed |
| EP-2377851-A1 | ISOQUINOLINE DERIVATIVE | Taisho Pharmaceutical Co., Ltd. (JP) | 2011-10-19 | — | — | EP | 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 (2 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-20110288293-A1 | ISOQUINOLINE DERIVATIVE | HRH1, HRH2, HRH4 | CYP17A1 315/4885KMT2A 1467/4885NPC1 161/4885 |
| US-20210387954-A1 | OXADIAZOLES AS FUNGICIDES | CYP1B1, CYP1A1, OXA1L | CYP17A1 64/4885KMT2A 1956/4885NPC1 2945/4885 |
“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.