⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2108013 | 0.81 | — | — | |
| SCHEMBL31296269 | 0.80 | HSD17B10 (0.32) | — | |
| SCHEMBL8467889 | 0.79 | — | — | |
| SCHEMBL5885082 | 0.78 | — | — | |
| SCHEMBL568430 | 0.77 | DNM1 (0.52) | — | |
| SCHEMBL11533725 | 0.77 | DNM1 (0.52) | — | |
| SCHEMBL31296256 | 0.75 | — | — | |
| SCHEMBL5967899 | 0.75 | — | — | |
| SCHEMBL31296271 | 0.75 | — | — | |
| SCHEMBL25937911 | 0.75 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117619158-B | Pore-diameter-adjustable polyether sulfone ultrafiltration membrane and preparation method and application thereof | 自然资源部天津海水淡化与综合利用研究所 | 2024-04-12 | — | — | CN | claimed |
| CN-108459096-A | Using black suitable piece extracting solution and the ginseng aconite injection liquid let pass in real time obtained by method in black suitable piece automation extraction process | 华润三九（雅安）药业有限公司 | 2018-08-28 | — | — | CN | claimed |
| CN-102731417-B | Dendrimer with alkynyl core and outer amino acid shell, and Huisgen 1,3-dipolar cycloaddition synthetic method and application thereof | UNIV SOUTH CHINA TECH | 2014-07-30 | — | — | CN | disclosed |
| CN-1205171-C | Process for producing 2-halomethylphenylacetic acid esters | SAGAMI CHEM RES (JP) | 2005-06-08 | — | — | CN | disclosed |
| CN-1186309-C | Process for producing 3-isochromanone | SAGAMI CHEM RES (JP) | 2005-01-26 | — | — | CN | disclosed |
| CN-1566072-A | Method for preparing 2-halomethyl phenylacetiate | SAGAMI CHEM RES (JP) | 2005-01-19 | — | — | CN | disclosed |
| CN-1328991-A | Process for producing 2-halomethylphenylacetic acid esters | SAGAMI CHEMICA RES CT (JP) | 2002-01-02 | — | — | CN | disclosed |
| EP-0950698-A1 | Use of aqueous compositions as laminating adhesive | BASF AKTIENGESELLSCHAFT (DE) | 1999-10-20 | — | — | EP | disclosed |
| US-5886211-A | Process for producing 2-(halomethyl)phenylacetic acid esters | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1999-03-23 | — | — | US | disclosed |
| CN-1193314-A | Process for producing 2-halomethylphenylacetic acid esters | SAGAMI CHEM RES (JP) | 1998-09-16 | — | — | CN | disclosed |
| EP-0834497-A1 | PROCESS FOR PRODUCING 2-(HALOMETHYL)PHENYLACETIC ACID ESTERS | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1998-04-08 | — | — | EP | disclosed |