⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1495363 | 1.00 | — | — | |
| SCHEMBL666609 | 1.00 | — | — | |
| SCHEMBL12951565 | 0.82 | SLC22A6 (0.50) | — | |
| SCHEMBL1079959 | 0.82 | — | — | |
| SCHEMBL5437765 | 0.81 | SLC22A6 (0.62) | — | |
| SCHEMBL4721742 | 0.81 | SLC22A6 (0.62) | — | |
| SCHEMBL3902208 | 0.81 | SLC22A6 (0.62) | — | |
| SCHEMBL13573121 | 0.80 | SLC22A6 (0.48) | — | |
| SCHEMBL17493151 | 0.79 | SLC22A6 (0.42) | — | |
| SCHEMBL5183814 | 0.79 | SLC22A6 (0.42) | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3345917-B1 | ANTIPROTOZOAL COMPOUNDS | BACOBA AG (CH) | 2021-11-17 | — | — | EP | disclosed |
| EP-2986724-B1 | DESIGNER CELLS FOR ENANTIOSELECTIVE REDUCTION OF KETONES AND USE THEREOF IN EFFICIENT PRODUCTION OF ENANTIOENRICHED ALCOHOLS | COUNCIL SCIENT IND RES (IN) | 2018-10-03 | — | — | EP | disclosed |
| CN-108077516-A | A kind of dragon chinensis particle chocolate and preparation method thereof | 浙江海洋大学 | 2018-05-29 | — | — | CN | disclosed |
| US-9790524-B2 | Designer cells for enantioselective reduction of ketones and use thereof in efficient production of enantioenriched alcohols | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2017-10-17 | — | — | US | disclosed |
| US-20160289713-A1 | DESIGNER CELLS FOR ENANTIOSELECTIVE REDUCTION OF KETONES AND USE THEREOF IN EFFICIENT PRODUCTION OF ENANTIOENRICHED ALCOHOLS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2016-10-06 | — | — | US | disclosed |
| EP-1249446-B1 | Use of thio derivates as flavoring ingredients | FIRMENICH & CIE (CH) | 2007-03-07 | — | — | EP | disclosed |
| US-7145030-B2 | Production method for optically active N-aryl-β-amino acid compounds | AJINOMOTO CO., INC. (JP) | 2006-12-05 | — | — | US | disclosed |
| US-7008919-B2 | Use of thio derivatives as perfuming and flavoring ingredients | FIRMENICH SA (CH) | 2006-03-07 | — | — | US | disclosed |
| US-20040267043-A1 | Production method for optically active N-aryl-beta-amino acid compounds | AJINOMOTO CO., INC. (JP) | 2004-12-30 | — | — | US | disclosed |
| EP-1471050-A1 | Production method for optically active N-aryl-beta-amino acid compounds | Ajinomoto Co., Inc. (JP) | 2004-10-27 | — | — | EP | disclosed |
| US-20030040460-A1 | Use of thio derivatives as perfuming and flavoring ingredients | FIRMENICH SA (CH) | 2003-02-27 | — | — | US | disclosed |
| EP-1249446-A2 | Use of thio derivates as perfuming and flavoring ingredients | FIRMENICH SA (CH) | 2002-10-16 | — | — | EP | disclosed |
| EP-1019386-A1 | REVERSE HYDROXAMATE DERIVATIVES AS METALLOPROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2000-07-19 | — | — | EP | disclosed |
| WO-1998038179-A1 | REVERSE HYDROXAMATE DERIVATIVES AS METALLOPROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 1998-09-03 | — | — | WO | disclosed |
| EP-0527838-A1 | PROCESS FOR PREPARING OPTICALLY PURE 1,4-DIOLS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-02-24 | — | — | EP | disclosed |
| WO-1991018132-A1 | PROCESS FOR PREPARING OPTICALLY PURE 1,4-DIOLS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-11-28 | — | — | WO | disclosed |
| US-5021131-A | Optically pure 1,4-diols | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-06-04 | — | — | US | disclosed |