⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL234175 | 0.74 | — | — | |
| SCHEMBL7266312 | 0.74 | — | — | |
| Trimethylammonium SCHEMBL2492577 | 0.65 | — | — | |
| SCHEMBL8704029 | 0.65 | — | — | |
| SCHEMBL22589391 | 0.61 | — | — | |
| SCHEMBL986125 | 0.61 | — | — | |
| SCHEMBL22589614 | 0.61 | ALDH1A1 (0.36) | — | |
| SCHEMBL2709128 | 0.61 | ALDH1A1 (0.36) | — | |
| SCHEMBL8613099 | 0.61 | — | — | |
| SCHEMBL165360 | 0.61 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106502061-B | Laminated electronic electrophotographic photoconductor | 京瓷办公信息系统株式会社 | 2019-11-08 | — | — | CN | disclosed |
| CN-109762513-B | A method of improving Silica Surface material and instant drying adhesive adhesive strength | 三峡大学 | 2019-10-08 | — | — | CN | disclosed |
| CN-109762513-A | A method of improving Silica Surface material and instant drying adhesive adhesive strength | 三峡大学 | 2019-05-17 | — | — | CN | disclosed |
| CN-109439707-A | The enzymatic preparation method of emtricitabine | 武汉工程大学 | 2019-03-08 | — | — | CN | disclosed |
| CN-109054395-A | A kind of high temperature resistant halogen-free flame-retardant silicon rubber and preparation method thereof | 华南理工大学 | 2018-12-21 | — | — | CN | disclosed |
| CN-108431136-A | Polyimide material, method for producing same, and polyimide precursor composition used for production thereof | 宇部兴产株式会社 | 2018-08-21 | — | — | CN | disclosed |
| CN-108299471-A | A kind of improvement preparation process of cefmetazole intermediate | 重庆常捷医药有限公司 | 2018-07-20 | — | — | CN | disclosed |
| CN-104130301-A | Preparation method of gemcitabine hydrochloride intermediate | CHEN XIN | 2014-11-05 | — | — | CN | disclosed |
| CN-103254415-A | Crystallized polyethylene terephthalate containing silicon and process for producing the same | OFER ZEEV | 2013-08-21 | — | — | CN | disclosed |
| CN-101362855-B | Unsaturated polyester resin | EVONIK DEGUSSA GMBH | 2012-09-05 | — | — | CN | disclosed |
| WO-2011061339-A1 | SUBSTRATE HAVING A NITROGEN-CONTAINING PLASMA POLYMER COATING | Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) | 2011-05-26 | — | — | WO | disclosed |
| CN-101362855-A | Unsaturated polyester resin | EVONIK DEGUSSA GMBH (DE) | 2009-02-11 | — | — | CN | disclosed |
| CN-101173045-A | Method for producing low-hydroxyl value high-temperature sulfuration silicon rubber raw rubber | JIANGSU HONGDA NEW MATERIAL CO (CN) | 2008-05-07 | — | — | CN | disclosed |