Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.45 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.44 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | EEF2K | O00418 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12611759 | 1.00 | ESR1 (0.45) | ESR1ESR2GABBR2GABBR1TRPA1 | |
| SCHEMBL11444487 | 0.98 | ESR1 (0.44) | ESR1ESR2GABBR2GABBR1TRPA1 | |
| SCHEMBL11167685 | 0.91 | ESR1 (0.45) | ESR1ESR2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL11155217 | 0.91 | ESR1 (0.45) | ESR1ESR2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL11159272 | 0.91 | LMNA (0.55) | ESR1ESR2GABBR2GABBR1ALDH1A1 | |
| SCHEMBL10697315 | 0.91 | CYP2C9 (0.54) | ESR1ESR2GABBR2GABBR1TSHR | |
| SCHEMBL11160153 | 0.91 | LMNA (0.55) | ESR1ESR2GABBR2GABBR1ALDH1A1 | |
| SCHEMBL11159850 | 0.91 | CYP2C9 (0.54) | ESR1ESR2GABBR2GABBR1TSHR | |
| SCHEMBL11151209 | 0.87 | ALDH1A1 (0.55) | ESR1ESR2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL11161185 | 0.87 | PBRM1 (0.51) | CYP2C19ALDH1A1LMNASMN1; SMN2NPSR1 |
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 64 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9049863-B2 | Substituted (3R,4R)-4-cyan-3,4-diphenylbutanoates, method for the production thereof and use thereof as herbicides and plant growth regulators | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-06-09 | — | — | US | claimed |
| US-4224052-A | Polysubstituted butanoic acids, esters and derivatives thereof utilizing the same as herbicides | AMERICAN CYANAMID COMPANY (US) | 1980-09-23 | — | — | US | claimed |
| EP-0005341-A2 | Polysubstituted butanoic acids, esters and derivatives thereof useful as herbicides, Compositions containing them and their use | AMERICAN CYANAMID COMPANY (US) | 1979-11-14 | — | — | EP | claimed |
| US-10172350-B2 | Substituted 5-hydroxy-2-phenyl-3-heteroaryl pentanenitrile derivatives, method for the production thereof and use thereof as herbicides and/or plant growth regulators | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2019-01-08 | — | — | US | disclosed |
| EP-2686296-B1 | SUBSTITUTED 4-CYAN-3-(2,6-DIFLUOROPHENYL)-4-PHENYLBUTANOATES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS | BAYER CROPSCIENCE AG (DE) | 2018-09-26 | — | — | EP | disclosed |
| US-10021877-B2 | Substituted 5-hydroxy-2,3-diphenylpentanonitrile derivatives, processes for their preparation and their use as herbicides and/or plant growth regulators | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2018-07-17 | — | — | US | disclosed |
| EP-2693878-B1 | SUBSTITUTED (3R,4R)-4-CYAN-3,4-DIPHENYLBUTANOATES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS | BAYER IP GMBH (DE) | 2018-06-27 | — | — | EP | disclosed |
| EP-3203841-B1 | SUBSTITUTED 5-HYDROXY-2-PHENYL-3-HETEROARYLPENTANONITRILE DERIVATIVES, METHOD FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND/OR PLANT GROWTH REGULATORS | BAYER CROPSCIENCE AG (DE) | 2018-06-13 | — | — | EP | disclosed |
| US-9957248-B2 | Substituted 5-hydroxy-2-heteroaryl-3-phenylpentanonitrile derivatives, processes for their preparation and their use as herbicides and/or plant growth regulators | BAYER CROPSCIENCE AKTIENGESELLSHAFT (DE) | 2018-05-01 | — | — | US | disclosed |
| US-9951028-B2 | Agricultural chemicals | REDAG CROP PROTECTION LTD. (GB) | 2018-04-24 | — | — | US | disclosed |
| US-9951028-B2 | Agricultural chemicals | REDAG CROP PROTECTION LTD. (GB) | 2018-04-24 | — | — | US | disclosed |
| WO-2009058274-A1 | CHEMICAL MECHANICAL POLISHING AND WAFER CLEANING COMPOSITION COMPRISING AMIDOXIME COMPOUNDS AND ASSOCIATED METHOD FOR USE | EKC TECHNOLOGY, INC. (US) | 2009-05-07 | — | — | WO | disclosed |
| US-20090107520-A1 | AMIDOXIME COMPOUNDS AS CHELATING AGENTS IN SEMICONDUCTOR PROCESSES | EKC TECHNOLOGY, INC. | 2009-04-30 | — | — | US | disclosed |
| US-4898609-A | HERBICIDES | AMERICAN CYANAMID COMPANY (US) | 1990-02-06 | — | — | US | disclosed |
| EP-0270830-A1 | Method for regulating plant growth using polysubstituted butyric acids, esters and derivatives thereof | AMERICAN CYANAMID COMPANY (US) | 1988-06-15 | — | — | EP | disclosed |
| EP-0266725-A1 | 4-cyano-4-(fluorophenyl)-3-(substituted phenyl) butyric acids, esters and derivatives thereof, and a method of selectively controlling undesirable vegetation in rice therewith | AMERICAN CYANAMID COMPANY (US) | 1988-05-11 | — | — | EP | disclosed |
| US-4383848-A | Polysubstituted butanoic acids, esters and derivatives thereof utilizing the same as herbicides | AMERICAN CYANAMID COMPANY (US) | 1983-05-17 | — | — | US | disclosed |
| US-4313754-A | Polysubstituted butanoic acids, esters and derivatives thereof utilizing the same as herbicides | AMERICAN CYANAMID COMPANY (US) | 1982-02-02 | — | — | US | disclosed |
| US-4224052-A | Polysubstituted butanoic acids, esters and derivatives thereof utilizing the same as herbicides | AMERICAN CYANAMID COMPANY (US) | 1980-09-23 | — | — | US | disclosed |
| EP-0005341-A2 | Polysubstituted butanoic acids, esters and derivatives thereof useful as herbicides, Compositions containing them and their use | AMERICAN CYANAMID COMPANY (US) | 1979-11-14 | — | — | 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-10172350-B2 | Substituted 5-hydroxy-2-phenyl-3-heteroaryl pentanenitrile derivatives, method for the production thereof and use thereof as herbicides and/or plant growth regulators | HPD, HAAO, GRHPR | ESR1 4792/4885ESR2 4043/4885GABBR2 693/4885 |
| US-10021877-B2 | Substituted 5-hydroxy-2,3-diphenylpentanonitrile derivatives, processes for their preparation and their use as herbicides and/or plant growth regulators | HPD, DDT, HDHD5 | ESR1 4570/4885ESR2 3421/4885GABBR2 1249/4885 |
“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.