⚠ 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 | |
|---|---|---|---|---|
| Hydrogen Sulfide SCHEMBL28853138 | 0.97 | PNMT (0.50) | — | |
| Cyclohexane SCHEMBL28485404 | 0.92 | PNMT (0.46) | — | |
| SCHEMBL29405036 | 0.81 | PNMT (0.63) | — | |
| SCHEMBL15247 | 0.81 | PNMT (0.63) | — | |
| SCHEMBL21296567 | 0.79 | HSPA5 (0.46) | — | |
| SCHEMBL16775680 | 0.78 | TAAR1 (0.58) | — | |
| Benzene SCHEMBL734438 | 0.78 | DPP4 (0.62) | — | |
| Hydrochloric Acid SCHEMBL2522138 | 0.78 | PNMT (0.60) | — | |
| Hydrochloric Acid SCHEMBL31276815 | 0.78 | PNMT (0.60) | — | |
| Water SCHEMBL6142580 | 0.78 | PNMT (0.60) | — |
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 1046 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110418792-A | Process for preparing 3, 6-disubstituted imidazo [1,2-b ] pyridazine derivatives | DAIICHI SANKYO CO LTD | 2019-11-05 | — | — | CN | claimed |
| CN-110054541-A | A kind of preparation method of deuterated aromatic compound | 安徽秀朗新材料科技有限公司 | 2019-07-26 | — | — | CN | claimed |
| CN-107936057-B | A kind of preparation method of diaryl phosphorus chlorine compound | 河南省科学院化学研究所有限公司 | 2019-07-16 | — | — | CN | claimed |
| CN-110003231-A | 1,1- spiral shell norbornane-pyrans simultaneously [4,3-b] chromone compounds and its preparation method and application | 遵义医科大学 | 2019-07-12 | — | — | CN | claimed |
| CN-109369686-A | One kind being based on Thienopyrroles diketone type small molecule receptor material and its preparation and application | 华南理工大学 | 2019-02-22 | — | — | CN | claimed |
| CN-109111565-A | A kind of D-A type conjugated polymer and its preparation method and application | 南昌航空大学 | 2019-01-01 | — | — | CN | claimed |
| CN-105017358-B | A kind of method of synthesis of methylamines base abamectin benzoate | 内蒙古嘉宝仕生物科技股份有限公司 | 2018-07-10 | — | — | CN | claimed |
| CN-105732477-B | Intramolecular charge transfer compound and synthesis method and application thereof | 浙江工业大学 | 2018-05-08 | — | — | CN | claimed |
| CN-107987034-A | Preparation method of dibenzo [ c, e ] [1,2] thiazine-5-oxo series compound with tricyclic system structure | 江西师范大学 | 2018-05-04 | — | — | CN | claimed |
| CN-107739309-A | A kind of double carbonylation preparation method of palladium chtalyst acetylene | 中国成达工程有限公司 | 2018-02-27 | — | — | CN | claimed |
| CN-105713022-A | Benzimidazolyl quinoline cuprous complex orange phosphorescent material | 中国计量大学 | 2016-06-29 | — | — | CN | claimed |
| CN-105051052-A | Bis(6-methyl-3-sulphophenyl)(2-methylphenyl)phosphine, ammonium salt thereof, and method for producing same | KURARAY CO | 2015-11-11 | — | — | CN | claimed |
| CN-103012623-B | Metalloscene catalyst, its synthesis and purposes in olefin polymerization | NOVOLEN TECH HOLDINGS CV (DE) | 2015-09-16 | — | — | CN | claimed |
| CN-103012623-A | Metallocene catalysts, their synthesis and their use for the polymerization of olefins | NOVOLEN TECH HOLDINGS CV | 2013-04-03 | — | — | CN | claimed |
| CN-101910216-A | Racemoselective synthesis of ansa-metallocene compounds, catalysts containing the same, process for preparing olefin polymers by using the catalysts and olefin homopolymers and copolymers | NOVOLEN TECH HOLDINGS CV | 2010-12-08 | — | — | CN | claimed |
| CN-100503553-C | Cavity-transferring material and its preparation method | CHINESE ACAD INST CHEMISTRY (CN) | 2009-06-24 | — | — | CN | claimed |
| CN-101389685-A | Block copolymer | SUMITOMO CHEMICAL CO (JP) | 2009-03-18 | — | — | CN | claimed |
| CN-1880298-A | Cavity-transferring material and its preparation method | CHINESE ACAD INST CHEMISTRY (CN) | 2006-12-20 | — | — | CN | claimed |
| CN-1250580-C | Catalyst system | BASSEL POLYPROPYLENE GMBH (DE) | 2006-04-12 | — | — | CN | claimed |
| CN-1301272-A | Catalyst system | BASSEL POLYPROPYLENE GMBH (DE) | 2001-06-27 | — | — | CN | claimed |