Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| Carbon Dioxide SCHEMBL28377710 | 0.95 | CYP1A2 (0.51) | CYP1A2TSHRPDE4DKMT2AKDM4E | |
| SCHEMBL28125301 | 0.90 | CYP1A2 (0.46) | CYP1A2TSHRKMT2AKDM4EMAPT | |
| SCHEMBL20488640 | 0.85 | ALDH1A1 (0.50) | CYP1A2TSHRKDM4EMAPTL3MBTL1 | |
| SCHEMBL29819645 | 0.85 | CYP1A2 (0.43) | CYP1A2TSHRPDE4DKMT2AKDM4E | |
| SCHEMBL20570815 | 0.82 | TSHR (0.53) | CYP1A2TSHRPDE4DKDM4EMAPT | |
| SCHEMBL21165934 | 0.81 | CYP1A2 (0.41) | CYP1A2TSHRPDE4DKMT2AKDM4E | |
| SCHEMBL29291579 | 0.81 | TSHR (0.54) | CYP1A2TSHRPDE4DKDM4EMAPT | |
| SCHEMBL27970370 | 0.81 | TSHR (0.51) | CYP1A2TSHRPDE4DKDM4EMAPT | |
| SCHEMBL20357845 | 0.81 | CYP1A2 (0.35) | CYP1A2TSHRKMT2AKDM4EMAPT | |
| SCHEMBL20920374 | 0.80 | ALDH1A1 (0.51) | CYP1A2TSHRKMT2AKDM4EMAPT |
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 1059 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110139862-B | Substituted bicyclic heterocyclic derivatives useful as ROMK channel inhibitors | 百时美施贵宝公司 | 2024-01-16 | — | — | CN | claimed |
| CN-113880769-B | Chelating agent for metal zirconium marking and synthetic method and application thereof | 华中科技大学 | 2023-03-31 | — | — | CN | claimed |
| CN-112107568-B | Diaryl amide compound and application thereof | 北京龙嘉博创医药科技有限公司 | 2022-03-25 | — | — | CN | claimed |
| CN-113880769-A | Chelating agent for metal zirconium marking and synthetic method and application thereof | 华中科技大学 | 2022-01-04 | — | — | CN | claimed |
| CN-212199075-U | Impurity removing device for producing 4-pyrazole ethyl formate | 南京麦瑞米生物技术有限公司 | 2020-12-22 | — | — | CN | claimed |
| CN-211799307-U | Filter equipment is used in production of 4 pyrazole ethyl formate | 南京麦瑞米生物技术有限公司 | 2020-10-30 | — | — | CN | claimed |
| CN-211800833-U | Reation kettle is used in production of 4 pyrazole ethyl formate | 南京麦瑞米生物技术有限公司 | 2020-10-30 | — | — | CN | claimed |
| CN-211771011-U | 4 pyrazole ethyl formate purification device | 南京麦瑞米生物技术有限公司 | 2020-10-27 | — | — | CN | claimed |
| CN-106187894-A | The preparation method of 1 methyl 3 ethyl 4 chlorine 5 pyrazole carboxylic acid ethyl ester | 潍坊鑫诺化工有限公司 | 2016-12-07 | — | — | CN | claimed |
| EP-2531490-A1 | CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS | Novartis AG (CH) | 2012-12-12 | — | — | EP | claimed |
| WO-2011095450-A1 | CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS | NOVARTIS AG (CH) | 2011-08-11 | — | — | WO | claimed |
| EP-1917247-A1 | 4,5-DIHYDR0-1H-PYRAZOLE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS | Laboratorios del Dr. Esteve S.A. (ES) | 2008-05-07 | — | — | EP | claimed |
| WO-2007009690-A1 | HETEROCYCLYL-SUBSTITUTED PYRAZOLINE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS | LABORATORIOS DEL DR. ESTEVE, S.A (ES) | 2007-01-25 | — | — | WO | claimed |
| WO-2007009689-A1 | 4,5-DIHYDR0-1H-PYRAZOLE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS | LABORATORIOS DEL DR.ESTEVE, S.A. (ES) | 2007-01-25 | — | — | WO | claimed |
| CN-1449247-A | Selective herbicides based on arylsulfonylaminocarbonyl triazolinones | BAYER AG (DE) | 2003-10-15 | — | — | CN | claimed |
| EP-0293220-B1 | Pharmacologically active 2-and 3-substituted (1', 5'-diaryl-3-pyrazolyl)-N-Hydroxypropanamides and method for synthesizing | ORTHO PHARMA CORP (US) | 1994-08-31 | — | — | EP | claimed |
| EP-0293220-A2 | Pharmacologically active 2-and 3-substituted (1', 5'-diaryl-3-pyrazolyl)-N-Hydroxypropanamides and method for synthesizing | ORTHO PHARMACEUTICAL CORPORATION (US) | 1988-11-30 | — | — | EP | claimed |
| JP-6041455-A | — | — | None | — | — | JP | disclosed |
| JP-H0641455-A | FIBER REACTIVE MONOAZO YELLOW DYE | HOECHST CELANESE CORP | 1994-02-15 | — | — | JP | disclosed |
| CN-86108643-A | Insecticidal method using N-phenylpyrazoles | — | 1987-07-29 | — | — | CN | disclosed |