Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 1.00 |
| ▸ | PLAU | P00749 | 2/20 | 0.56 |
| ▸ | F12 | P00748 | 1/20 | 0.56 |
| ▸ | NCF1 | P14598 | 1/20 | 0.56 |
| ▸ | NOS3 | P29474 | 1/20 | 0.56 |
| ▸ | NOS1 | P29475 | 1/20 | 0.56 |
| ▸ | NOS2 | P35228 | 1/20 | 0.56 |
| ▸ | BACE1 | P56817 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | APEX1 | P27695 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL27536286 | 0.98 | CYP2A6 (0.95) | CYP2A6PLAUF12NCF1NOS3 | |
| Hydrochloric Acid SCHEMBL29827768 | 0.98 | CYP2A6 (0.95) | CYP2A6PLAUF12NCF1NOS3 | |
| Hydrochloric Acid SCHEMBL2830989 | 0.98 | CYP2A6 (0.95) | CYP2A6PLAUF12NCF1NOS3 | |
| SCHEMBL27891679 | 0.92 | CYP2A6 (0.84) | CYP2A6PLAUF12NCF1NOS3 | |
| Sulfuric Acid SCHEMBL27870093 | 0.90 | CYP2A6 (0.81) | CYP2A6PLAUF12NCF1NOS3 | |
| Sulfuric Acid SCHEMBL27870095 | 0.90 | CYP2A6 (0.81) | CYP2A6PLAUF12NCF1NOS3 | |
| Isothiocyanate SCHEMBL28184241 | 0.88 | CYP2A6 (0.78) | CYP2A6PLAUF12NCF1NOS3 | |
| Formic Acid SCHEMBL28681087 | 0.88 | CYP2A6 (0.78) | CYP2A6PLAUF12NCF1NOS3 | |
| SCHEMBL28453722 | 0.87 | CYP2A6 (0.75) | CYP2A6PLAUF12NCF1NOS3 | |
| Isoquinoline SCHEMBL28300310 | 0.87 | CYP2A6 (0.75) | CYP2A6PLAUF12NCF1NOS3 |
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
Appears in 3768 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119751857-A | Non-isocyanate polyurea and preparation method thereof, water-based non-isocyanate polyurea and preparation method thereof, and anti-corrosion coating, waterproof coating and fireproof coating containing water-based non-isocyanate polyurea and preparation method thereof | 山西省建筑科学研究院集团有限公司 | 2025-04-04 | — | — | CN | claimed |
| CN-118791430-A | Long afterglow molecule, preparation method and application thereof, and detection reagent | 上海交通大学 | 2024-10-18 | — | — | CN | claimed |
| CN-114409595-B | 1-Styryl isoquinoline derivative and preparation and application thereof | 南华大学附属第一医院 | 2024-05-14 | — | — | CN | claimed |
| WO-2024017178-A1 | SUBSTITUTED HYDANTOIN COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS | AVITAR BIOSCIENCES, INC. (CN) | 2024-01-25 | — | — | WO | claimed |
| CN-115261007-B | Ocean oil field completion fluid and flowback recycling treatment method | 中海油天津化工研究设计院有限公司 | 2023-08-04 | — | — | CN | claimed |
| CN-115261007-A | Offshore oil field well completion fluid and flowback recycling treatment method | 中海油天津化工研究设计院有限公司 | 2022-11-01 | — | — | CN | claimed |
| CN-111187287-B | Method for catalyzing hydroboration and hydrosilation reaction of nitrogen heterocyclic compound | 苏州大学 | 2022-06-14 | — | — | CN | claimed |
| CN-114409595-A | 1-styryl isoquinoline derivative and preparation and application thereof | 南华大学附属第一医院 | 2022-04-29 | — | — | CN | claimed |
| EP-3924349-A2 | AMINO ACID DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISEASES | The Roskamp Institute (US) | 2021-12-22 | — | — | EP | claimed |
| CN-113683616-A | KRAS G12C mutein inhibitors | 广州百霆医药科技有限公司 | 2021-11-23 | — | — | CN | claimed |
| EP-0680953-A1 | 1-[Styryl]- and 1-[2'-(heteroaryl)-ethenyl]-isoquinoline derivatives, a process for preparing them as well as medicaments containing them and the use of them | EGIS GYOGYSZERGYAR RT. (HU) | 1995-11-08 | — | — | EP | claimed |
| EP-0544748-A1 | SPIRO CYCLOALKYLBENZENE-1,1'-(1',2',3',4'-TETRAHYDROISOQUINOLINES)] HAVING NEUROPROTECTIVE PROPERTIES. | FISONS CORP (US) | 1993-06-09 | — | — | EP | claimed |
| WO-1992022523-A2 | PEPTIDE DERIVATIVES OF COLLAGENASE INHIBITOR | RESEARCH CORPORATION TECHNOLOGIES, INC. (US) | 1992-12-23 | — | — | WO | claimed |
| WO-1992003420-A1 | SPIRO[CYCLOALKYLBENZENE-1,1'-(1',2',3',4'-TETRAHYDROISOQUINOLINES)] HAVING NEUROPROTECTIVE PROPERTIES | FISONS CORPORATION (US) | 1992-03-05 | — | — | WO | claimed |
| EP-0201221-B1 | 6-(1-ACYL-1-HYDROXY METHYL) PENICILLANIC ACID DERIVATIVES | PFIZER INC. (US) | 1990-08-01 | — | — | EP | claimed |
| US-4762921-A | 6-(1-acyl-1-hydroxymethyl)penicillanic acid derivatives | PFIZER INC. (US) | 1988-08-09 | — | — | US | claimed |
| EP-0126480-B1 | SUBSTITUTED ISOQUINOLINE DERIVATIVES, METHOD FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1988-01-20 | — | — | EP | claimed |
| US-4675186-A | 6-(1-acyl-1-hydroxymethyl)penicillanic acid derivatives | PFIZER INC. (US) | 1987-06-23 | — | — | US | claimed |
| EP-0201221-A1 | 6-(1-acyl-1-hydroxy methyl) penicillanic acid derivatives | PFIZER INC. (US) | 1986-11-12 | — | — | EP | claimed |
| US-4619861-A | COATING PARTICLES WITH ORGANONITROGEN OR ORGANOSULFUR POLYMER | TDK CORPORATION (JP) | 1986-10-28 | — | — | US | claimed |