⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3430469 | 0.72 | — | — | |
| SCHEMBL3431251 | 0.72 | — | — | |
| SCHEMBL14135309 | 0.66 | ALDH1A1 (0.37) | — | |
| SCHEMBL11918080 | 0.64 | — | — | |
| SCHEMBL910475 | 0.56 | — | — | |
| SCHEMBL17581051 | 0.55 | — | — | |
| SCHEMBL2380963 | 0.55 | — | — | |
| SCHEMBL20454641 | 0.54 | — | — | |
| SCHEMBL17303447 | 0.53 | — | — | |
| SCHEMBL24584130 | 0.53 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107848967-B | Cyclic quaternary ammonium salts as fuel or lubricant additives | 因诺斯佩克有限公司 | 2022-05-27 | — | — | CN | disclosed |
| US-10689589-B2 | Cyclic quaternary ammonium salts as fuel or lubricant additives | INNOSPEC LIMITED (GB) | 2020-06-23 | — | — | US | disclosed |
| CN-110483509-A | A method of synthesis azepine indoline derivative object | UNIV WENZHOU | 2019-11-22 | — | — | CN | disclosed |
| US-20180223203-A1 | CYCLIC QUATERNARY AMMONIUM SALTS AS FUEL OR LUBRICANT ADDITIVES | INNOSPEC LIMITED (GB) | 2018-08-09 | — | — | US | disclosed |
| CN-107848967-A | As fuel or the cyclic quaternary ammonium salts of lubricant additive | 因诺斯佩克有限公司 | 2018-03-27 | — | — | CN | disclosed |