Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28340796 | 0.93 | KMT2A (0.38) | EPHX1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL25447810 | 0.76 | KDM4E (0.52) | EPHX1KDM4E | |
| SCHEMBL25166810 | 0.74 | EPHX1 (0.66) | EPHX1FAAH | |
| SCHEMBL6647074 | 0.74 | EPHX1 (0.43) | EPHX1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL7554569 | 0.73 | MMP1 (0.31) | MMP1MMP2MMP3MMP9MMP8 | |
| SCHEMBL25166940 | 0.73 | SMN1; SMN2 (0.42) | ALDH1A1SMN1; SMN2KMT2AHTTMAPT | |
| SCHEMBL249164 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL6646763 | 0.72 | EPHX1 (0.42) | EPHX1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| Hydrochloric Acid SCHEMBL6649073 | 0.72 | EPHX1 (0.42) | EPHX1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL25166821 | 0.72 | ANPEP (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0017170-B1 | IMPROVED PROCESS FOR THE PREPARATION OF CEPHAMYCIN ANTIBIOTICS | MERCK & CO. INC. (US) | 1983-04-13 | — | — | EP | claimed |
| EP-0017170-A1 | Improved process for the preparation of cephamycin antibiotics | MERCK & CO. INC. (US) | 1980-10-15 | — | — | EP | claimed |
| US-4218563-A | TRANSACYLATION IN PRESENCE OF N-TRIMETHYLSILYL LOWER ALKYL CARBAMATES | MERCK & CO., INC. (US) | 1980-08-19 | — | — | US | claimed |
| US-9249148-B2 | Tris(hetero)arylpyrazoles and use thereof | AICURIS GMBH & CO. KG (DE) | 2016-02-02 | — | — | US | disclosed |
| WO-2015195179-A2 | METAL ORGANIC FRAMEWORKS COMPRISING A PLURALITY OF SBUS WITH DIFFERENT METAL IONS AND/OR A PLURALITY OF ORGANIC LINKING LIGANDS WITH DIFFERENT FUNCTIONAL GROUPS. | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2015-12-23 | — | — | WO | disclosed |
| WO-2015161037-A1 | VERY LOW DENSITY METAL ORGANIC FRAMEWORKS WITH LARGE PORE VOLUMES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2015-10-22 | — | — | WO | disclosed |
| WO-2015157239-A1 | FUNCTIONALIZED AND MULTIVARIATE BTB-BASED METAL ORGANIC FRAMEWORKS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2015-10-15 | — | — | WO | disclosed |
| WO-2015121413-A1 | NEW ACTIVE PHARMACEUTICAL INGREDIENT COMBINATIONS WITH COMPOUNDS BASED ON TRI(HETERO)ARYL PYRAZOLES | AICURIS GMBH & CO. KG (DE) | 2015-08-20 | — | — | WO | disclosed |
| US-20150203500-A1 | TRIS(HETERO)ARYLPYRAZOLES AND USE THEREOF | AICURIS GMBH & CO. KG (DE) | 2015-07-23 | — | — | US | disclosed |
| EP-1266903-B1 | Method of preparing an organosilicon compound | DOW CORNING ASIA LTD (JP) | 2004-09-29 | — | — | EP | disclosed |
| US-6750344-B1 | MONOCYCLIC AMINE SCAFFOLD BEARING AT LEAST TWO SITES OF DIVERSITY, CYCLIZED TO FORM BICYCLIC AMINE SCAFFOLDS; 7-AMINO-PYRROLO(1,2-A)PYRAZIN-4-ONE COMPOUNDS | ISIS PHARMACEUTICALS, INC. | 2004-06-15 | — | — | US | disclosed |
| EP-1266903-A1 | Method of preparing an organosilicon compound | DOW CORNING ASIA, Ltd. (JP) | 2002-12-18 | — | — | EP | disclosed |
| US-6326506-B1 | HYDROSILATION | DOW CORNING ASIA, LTD. (JP) | 2001-12-04 | — | — | US | disclosed |
| US-6316626-B1 | Amine compounds and combinatorial libraries comprising same | ISIS PHARMACEUTICALS, INC. | 2001-11-13 | — | — | US | disclosed |
| WO-1999012034-A1 | AMINE COMPOUNDS AND COMBINATORIAL LIBRARIES COMPRISING SAME | ISIS PHARMACEUTICALS, INC. (US) | 1999-03-11 | — | — | 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-20150203500-A1 | TRIS(HETERO)ARYLPYRAZOLES AND USE THEREOF | TPMT, AHR, PAICS | EPHX1 2158/4885CHRNB2 3866/4885CHRNB4 4074/4885 |
“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.