Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | RORC | P51449 | 6/20 | 0.63 |
| ▸ | LMNA | P02545 | 5/20 | 0.63 |
| ▸ | MEN1 | O00255 | 4/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.63 |
| ▸ | MAPT | P10636 | 3/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | PKM | P14618 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | PPARG | P37231 | 1/20 | 0.63 |
| ▸ | THPO | P40225 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL16922169 | 1.00 | NPSR1 (0.64) | NPSR1KDM4ERORCLMNAMEN1 | |
| Phosphine SCHEMBL28235319 | 0.98 | NPSR1 (0.62) | NPSR1KDM4ERORCLMNAMEN1 | |
| Acetic Acid SCHEMBL27779261 | 0.96 | NPSR1 (0.63) | NPSR1KDM4ERORCLMNAMEN1 | |
| Pyruvate SCHEMBL27565886 | 0.93 | NPSR1 (0.60) | NPSR1KDM4ERORCLMNAMEN1 | |
| Acetamide SCHEMBL28123803 | 0.93 | NPSR1 (0.60) | NPSR1KDM4ERORCLMNAMEN1 | |
| SCHEMBL10902402 | 0.90 | NPSR1 (0.71) | NPSR1KDM4ERORCLMNAMEN1 | |
| SCHEMBL10902888 | 0.89 | TSHR (0.59) | NPSR1KDM4ERORCLMNAMEN1 | |
| SCHEMBL2394121 | 0.88 | KDM4E (0.67) | NPSR1KDM4ERORCLMNAMEN1 | |
| SCHEMBL6314599 | 0.88 | MAPK1 (0.68) | NPSR1RORCLMNAMEN1KMT2A | |
| SCHEMBL10953243 | 0.87 | HSD17B10 (0.62) | NPSR1KDM4ERORCLMNAMEN1 |
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 288 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10092786-B2 | Fire extinguishing composition comprising aldoketones compound | XI'AN WESTPEACE FIRE TECHNOLOGY CO., LTD. (CN) | 2018-10-09 | — | — | US | claimed |
| CN-108373415-A | A kind of preparation method of two (bis- chloro- 5- nitrobenzophenones of 2,4-) carbonic esters | 常州大学 | 2018-08-07 | — | — | CN | claimed |
| CN-106496056-B | A kind of synthetic method of arylamides | 中国人民解放军63975部队 | 2018-03-02 | — | — | CN | claimed |
| CN-107200708-A | A kind of preparation method of vismodegib | 新发药业有限公司 | 2017-09-26 | — | — | CN | claimed |
| CN-105646231-B | A kind of preparation method of the nitrophenol of 2,4 dichloro 5 | 连云港市金囤农化有限公司 | 2017-09-22 | — | — | CN | claimed |
| CN-105175284-B | Amides compound, preparation method and its medical usage | 中国药科大学 | 2017-06-16 | — | — | CN | claimed |
| CN-106699570-A | Synthesis method for (2-chloro-5-iodophenyl)(4-fluorophenyl)ketone | 山东铂源药业有限公司 | 2017-05-24 | — | — | CN | claimed |
| CN-106366000-A | Preparation method of 2-chloro-5-nitrobenzophenone | 枣阳凤泽精细化工有限公司 | 2017-02-01 | — | — | CN | claimed |
| CN-205700577-U | Produce the reactor of 2-chloro-5-nitro benzophenone | 枣阳凤泽精细化工有限公司 | 2016-11-23 | — | — | CN | claimed |
| US-20160332016-A1 | Fire Extinguishing Composition Comprising Aldoketones Compound | NANO FIRE, LLC | 2016-11-17 | — | — | US | claimed |
| CN-102057918-A | Application of 4-alkyl-5-(1,2,4-triazole-1-yl)-2-benzyl imino thiazole in preparation of weedicide | UNIV HUNAN | 2011-05-18 | — | — | CN | claimed |
| CN-101152185-B | Use of heterocyclic compounds as SCCE inhibitors | AREXIS AB | 2010-12-08 | — | — | CN | claimed |
| CN-101184487-B | Bicyclic pyrazole compounds as antibacterial agents | JANSSEN PHARMACEUTICA NV | 2010-11-03 | — | — | CN | claimed |
| CN-100518740-C | Pharmaceutical use of heterocyclic compounds as SCCE inhibitors | AREXIS AB (SE) | 2009-07-29 | — | — | CN | claimed |
| EP-1794175-B1 | PROCESS FOR THE PREPARATION OF ESTRONE AND/OR ESTRADIOL-DERIVATES | ORGANON NV (NL) | 2008-08-13 | — | — | EP | claimed |
| CN-101184487-A | Bicyclic pyrazole compounds as antibacterial agents | JANSSEN PHARMACEUTICA NV (BE) | 2008-05-21 | — | — | CN | claimed |
| US-20070299268-A1 | Process for the Preparation of Estrone and/or Estradiol-Derivates | N.V. ORGANON (NL) | 2007-12-27 | — | — | US | claimed |
| CN-101010332-A | Process for the preparation of estrone and/or estradiol derivatives | ORGANON NV (NL) | 2007-08-01 | — | — | CN | claimed |
| EP-1794175-A1 | PROCESS FOR THE PREPARATION OF ESTRONE AND/OR ESTRADIOL-DERIVATES | N.V. Organon (NL) | 2007-06-13 | — | — | EP | claimed |
| WO-2006021554-A1 | PROCESS FOR THE PREPARATION OF ESTRONE AND/OR ESTRADIOL-DERIVATES | N.V. ORGANON (NL) | 2006-03-02 | — | — | WO | claimed |
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-20070299268-A1 | Process for the Preparation of Estrone and/or Estradiol-Derivates | CYP19A1, HSD17B11, HSD17B7 | NPSR1 530/4885KDM4E 388/4885RORC 1783/4885 |
“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.