⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27835 | 0.83 | — | — | |
| SCHEMBL28280747 | 0.77 | — | — | |
| SCHEMBL16068292 | 0.75 | — | — | |
| SCHEMBL10136738 | 0.73 | — | — | |
| SCHEMBL11185123 | 0.71 | — | — | |
| SCHEMBL21309259 | 0.71 | — | — | |
| SCHEMBL23226137 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL5560769 | 0.69 | ALDH1A1 (0.32) | — | |
| SCHEMBL3854552 | 0.68 | — | — | |
| SCHEMBL14755897 | 0.66 | ALDH1A1 (0.31) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108250434-A | Aromatic amine formic acid esters through isocyanates as predecessor through catalytic thermal response path to prepare the method for amide or polyamide | 大东树脂化学股份有限公司 | 2018-07-06 | — | — | CN | claimed |
| CN-107743502-A | Solidification composition filling | 爱客多有限公司 | 2018-02-27 | — | — | CN | claimed |
| CN-106810661-A | There is the delayed action catalyst of the polyurethane system stability containing halogen foaming agent for improving | 气体产品与化学公司 | 2017-06-09 | — | — | CN | claimed |
| CN-108250434-A | Aromatic amine formic acid esters through isocyanates as predecessor through catalytic thermal response path to prepare the method for amide or polyamide | 大东树脂化学股份有限公司 | 2018-07-06 | — | — | CN | disclosed |
| CN-107743502-A | Solidification composition filling | 爱客多有限公司 | 2018-02-27 | — | — | CN | disclosed |
| CN-104245683-B | Cyclic amine compound, composition and polyurethane foam prepared therefrom | 陶氏环球技术有限责任公司 | 2017-06-30 | — | — | CN | disclosed |
| CN-106810661-A | There is the delayed action catalyst of the polyurethane system stability containing halogen foaming agent for improving | 气体产品与化学公司 | 2017-06-09 | — | — | CN | disclosed |
| CN-104024299-B | Method for producing an insulated pipe with improved properties | 巴斯夫欧洲公司 | 2017-05-24 | — | — | CN | disclosed |