⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL10495157 | 0.98 | LCK (0.43) | — | |
| SCHEMBL11716684 | 0.98 | LCK (0.43) | — | |
| Phosphine SCHEMBL27327625 | 0.98 | LCK (0.39) | — | |
| SCHEMBL11287146 | 0.98 | LCK (0.43) | — | |
| SCHEMBL11286153 | 0.98 | LCK (0.43) | — | |
| SCHEMBL11284901 | 0.92 | — | — | |
| SCHEMBL8928316 | 0.81 | — | — | |
| SCHEMBL7873136 | 0.77 | — | — | |
| SCHEMBL16516307 | 0.75 | — | — | |
| SCHEMBL3266925 | 0.75 | — | — |
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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116574041-B | Isothiocyanate compound, preparation method and application thereof in preventing and controlling plant diseases | 北京大学现代农业研究院 | 2024-03-26 | — | — | CN | claimed |
| CN-116574041-A | Isothiocyanate compound, preparation method and application thereof in preventing and controlling plant diseases | 北京大学现代农业研究院 | 2023-08-11 | — | — | CN | claimed |
| CN-107468685-A | For treating the pharmaceutical composition and compound of hypertension and heart failure | 科贝源(北京)生物医药科技有限公司 | 2017-12-15 | — | — | CN | claimed |
| CN-115710205-B | Gemini anionic surfactant, preparation method thereof, high-temperature-resistant surfactant composition and oil reservoir oil displacement method | 中国石油化工股份有限公司 | 2024-08-30 | — | — | CN | disclosed |
| CN-116574041-B | Isothiocyanate compound, preparation method and application thereof in preventing and controlling plant diseases | 北京大学现代农业研究院 | 2024-03-26 | — | — | CN | disclosed |
| CN-116574041-A | Isothiocyanate compound, preparation method and application thereof in preventing and controlling plant diseases | 北京大学现代农业研究院 | 2023-08-11 | — | — | CN | disclosed |
| CN-115710205-A | Gemini anionic surfactant and preparation method thereof, high-temperature-resistant surfactant composition and oil reservoir oil displacement method | 中国石油化工股份有限公司 | 2023-02-24 | — | — | CN | disclosed |
| CN-107522686-B | Thioether compound and preparation method thereof | 北京化工大学 | 2020-11-20 | — | — | CN | disclosed |
| CN-108250435-B | Thick oil emulsifying viscosity reducer and application thereof | 河南大学 | 2020-04-03 | — | — | CN | disclosed |
| US-10562878-B2 | Cycloalkylamines as monoamine reuptake inhibitors | SUNOVION PHARAMCEUTICALS INC. (US) | 2020-02-18 | — | — | US | disclosed |
| CN-110023309-A | Indazole derivatives as glucagon receptor antagonists | 詹森药业有限公司 | 2019-07-16 | — | — | CN | disclosed |
| US-20070203111-A1 | Cycloalkylamines as monoamine reuptake inhibitors | SEPRACOR INC. (US) | 2007-08-30 | — | — | US | disclosed |
| WO-2007081857-A2 | CYCLOALKYLAMINES AS MONOAMINE REUPTAKE INHIBITORS | SEPRACOR INC. (US) | 2007-07-19 | — | — | WO | disclosed |
| EP-1539744-A4 | N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY | VICURON PHARM INC (US) | 2007-06-06 | — | — | EP | disclosed |
| EP-1539744-A2 | N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY | Vicuron Pharmaceuticals, Inc. (US) | 2005-06-15 | — | — | EP | disclosed |
| CN-1604776-A | 4-4-alkoxy-3-hydroxyphenyl-2-pyrrolidone derivatives as pde-4 inhibitors for the treatment of neurological syndromes | MEMORY PHARM CORP (US) | 2005-04-06 | — | — | CN | disclosed |
| WO-2004007444-A2 | N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY | VICURON PHARMACEUTICALS, INC. (US) | 2004-01-22 | — | — | WO | disclosed |
| US-6482905-B1 | Unsymmetric unbridged bis-indenyl metallocenes and their use | PHILLIPS PETROLEUM COMPANY | 2002-11-19 | — | — | US | disclosed |
| EP-0000555-B1 | PROCESS FOR THE PREPARATION OF OXIRANES SUBSTITUTED BY HALOGEN ALKYL | BAYER AG (DE) | 1982-02-10 | — | — | EP | disclosed |
| EP-0000554-A1 | Process for the preparation of oxiranes substituted by halogen alkyl | BAYER AG (DE) | 1979-02-07 | — | — | EP | disclosed |