⚠ 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL1121844 | 1.00 | ACHE (0.92) | — | |
| Toluene SCHEMBL1 | 0.96 | — | — | |
| Toluene SCHEMBL4429042 | 0.96 | ACHE (1.00) | — | |
| SCHEMBL12344964 | 0.96 | ACHE (1.00) | — | |
| Toluene SCHEMBL8824270 | 0.96 | ACHE (1.00) | — | |
| Toluene SCHEMBL175861 | 0.96 | ACHE (1.00) | — | |
| Toluene SCHEMBL8938900 | 0.96 | ACHE (1.00) | — | |
| SCHEMBL12344943 | 0.96 | ACHE (1.00) | — | |
| Toluene SCHEMBL4535818 | 0.96 | ACHE (1.00) | — | |
| Toluene SCHEMBL8433895 | 0.96 | ACHE (1.00) | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103450783-A | Plastic coating with good stability and preparation method thereof | WUJIANG YINGLIDA PLASTIC PACKAGE CO LTD | 2013-12-18 | — | — | CN | claimed |
| CN-116712709-A | PVC yoga mat and preparation method thereof | 金华市禾宝日用品有限公司 | 2023-09-08 | — | — | CN | disclosed |
| CN-214553486-U | Device for synthesizing zinc p-toluenesulfinate | 嘉兴市金利化工有限责任公司 | 2021-11-02 | — | — | CN | disclosed |
| CN-211204755-U | Flash evaporation dryer for drying zinc p-toluenesulfinate | 嘉兴市金利化工有限责任公司 | 2020-08-07 | — | — | CN | disclosed |
| CN-108623497-A | A kind of preparation method of 2- Cyano-4 '-methylbiphenyls | 上海新埠医药科技有限公司 | 2018-10-09 | — | — | CN | disclosed |
| CN-107406546-A | Process for producing oligomer and catalyst | JXTG能源株式会社 | 2017-11-28 | — | — | CN | disclosed |
| CN-103450783-A | Plastic coating with good stability and preparation method thereof | WUJIANG YINGLIDA PLASTIC PACKAGE CO LTD | 2013-12-18 | — | — | CN | disclosed |
| CN-101177406-B | Manufacturing technique of 2-(4-methyl phenyl) cyanobenzene | CHIZHOU WANWEI CHEMICAL CO., LTD. (CN) | 2011-12-07 | — | — | CN | disclosed |
| CN-101177406-A | Manufacturing technique of 2-(4-methyl phenyl) cyanobenzene | CHIZHOU WANWEI CHEMICAL CO LTD (CN) | 2008-05-14 | — | — | CN | disclosed |
| EP-0882772-B1 | Pigment compositions | CIBA SC HOLDING AG (CH) | 2003-06-25 | — | — | EP | disclosed |
| EP-0649883-B1 | Pigment compositions | CIBA SC HOLDING AG (CH) | 2001-08-08 | — | — | EP | disclosed |
| US-6096801-A | Pigment compositions | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2000-08-01 | — | — | US | disclosed |
| EP-0882772-A1 | Pigment compositions | Ciba SC Holding AG (CH) | 1998-12-09 | — | — | EP | disclosed |
| US-5614013-A | Pigment compositions | CIBA-GEIGY CORPORATION (US) | 1997-03-25 | — | — | US | disclosed |
| EP-0649883-A1 | Pigment compositions | CIBA-GEIGY AG (CH) | 1995-04-26 | — | — | EP | disclosed |
| US-4579720-A | USING HYDROXYMETHANE DIPHOSPHONIC ACID | PLAINS CHEMICAL DEVELOPMENT CO. (US) | 1986-04-01 | — | — | US | disclosed |
| US-4440646-A | HYDROXY OR HALOALKANEPHOSPHONATES | PLAINS CHEMICAL DEVELOPMENT CO. (US) | 1984-04-03 | — | — | US | disclosed |
| US-4188234-A | STABILIZATION OF VINYL POLYMERS, POLYPHOSPHONIC ACID CHELATING AGENT, PROTECTIVE COATINGS | PLAINS CHEMICAL DEVELOPMENT CO. (US) | 1980-02-12 | — | — | US | disclosed |
| US-4116990-A | OF NON-ALKALI METAL IONS WITH PHOSPHORUS CHELATING COMPOUND | PLAINS CHEMICAL DEVELOPMENT CO. (US) | 1978-09-26 | — | — | US | disclosed |
| US-4020091-A | TIN SALTS OF POLYPHOSPHONIC ACIDS | PLAINS CHEMICAL DEVELOPMENT CO. (US) | 1977-04-26 | — | — | US | disclosed |