⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7285763 | 0.69 | — | — | |
| SCHEMBL1814736 | 0.69 | — | — | |
| SCHEMBL530364 | 0.68 | CA2 (0.30) | — | |
| SCHEMBL1176679 | 0.65 | — | — | |
| SCHEMBL18396189 | 0.65 | — | — | |
| SCHEMBL1814739 | 0.65 | — | — | |
| SCHEMBL10815836 | 0.62 | — | — | |
| SCHEMBL10822015 | 0.62 | — | — | |
| SCHEMBL11322791 | 0.62 | — | — | |
| SCHEMBL899543 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5399552-A | Antibiotic peptides bearing aminoalkylthioether moieties | MERCK & CO, INC (US) | 1995-03-21 | — | — | US | claimed |
| EP-0538002-A1 | Aminoalkyl thioether compounds | MERCK & CO. INC. (US) | 1993-04-21 | — | — | EP | claimed |
| JP-5239096-A | — | — | None | — | — | JP | disclosed |
| CN-113227092-A | Compounds and methods of use thereof for treating cancer | 亚瑞克西斯制药公司 | 2021-08-06 | — | — | CN | disclosed |
| CN-105764850-B | Method and apparatus for preparing functionalized graphene and functionalized graphene | 韩华化学株式会社 | 2018-01-12 | — | — | CN | disclosed |
| CN-105764850-A | Method and apparatus for preparing functionalized graphene and functionalized graphene | 韩化石油化学株式会社 | 2016-07-13 | — | — | CN | disclosed |
| EP-2140264-A1 | METHODS OF USE OF SOLID SUPPORT MATERIAL FOR BINDING BIOMOLECULES | 3M Innovative Properties Company (US) | 2010-01-06 | — | — | EP | disclosed |
| WO-2008131063-A1 | METHODS OF USE OF SOLID SUPPORT MATERIAL FOR BINDING BIOMOLECULES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2008-10-30 | — | — | WO | disclosed |
| EP-1689709-A1 | N-SULFONYLDICARBOXIMIDE CONTAINING TETHERING COMPOUNDS | 3M Innovative Properties Company (US) | 2006-08-16 | — | — | EP | disclosed |
| WO-2005049565-A1 | N-SULFONYLDICARBOXIMIDE CONTAINING TETHERING COMPOUNDS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2005-06-02 | — | — | WO | disclosed |
| US-5516757-A | ANTIFUNGAL | MERCK & CO., INC. (US) | 1996-05-14 | — | — | US | disclosed |
| WO-1996008267-A1 | SEMI-SYNTHETIC LIPOPEPTIDES, COMPOSITIONS CONTAINING SAID LIPOPEPTIDES, AND METHODS OF USE | MERCK & CO., INC. (US) | 1996-03-21 | — | — | WO | disclosed |
| US-5399552-A | Antibiotic peptides bearing aminoalkylthioether moieties | MERCK & CO, INC (US) | 1995-03-21 | — | — | US | disclosed |
| US-5399552-A | Antibiotic peptides bearing aminoalkylthioether moieties | MERCK & CO, INC (US) | 1995-03-21 | — | — | US | disclosed |
| JP-H05239096-A | AMINOALKYLTHIOETHER COMPOUND | MERCK & CO INC | 1993-09-17 | — | — | JP | disclosed |
| EP-0538002-A1 | Aminoalkyl thioether compounds | MERCK & CO. INC. (US) | 1993-04-21 | — | — | EP | disclosed |
| EP-0538002-A1 | Aminoalkyl thioether compounds | MERCK & CO. INC. (US) | 1993-04-21 | — | — | EP | disclosed |