⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6186660 | 1.00 | — | — | |
| SCHEMBL5673620 | 0.94 | — | — | |
| SCHEMBL29249281 | 0.94 | — | — | |
| SCHEMBL7196556 | 0.79 | — | — | |
| Benzotriazole SCHEMBL9848222 | 0.72 | — | — | |
| SCHEMBL6614052 | 0.63 | — | — | |
| SCHEMBL29249280 | 0.61 | — | — | |
| SCHEMBL3988597 | 0.61 | — | — | |
| SCHEMBL1680480 | 0.61 | — | — | |
| SCHEMBL11329423 | 0.61 | — | — |
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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1899294-B1 | THERAPEUTIC AGENTS | MERCK SHARP & DOHME (GB) | 2015-03-18 | — | — | EP | disclosed |
| US-8163956-B2 | Inhibitors of GLYT1 transporters | MERCK SHARP & DOHME CORP. (US) | 2012-04-24 | — | — | US | disclosed |
| US-20090286765-A1 | Therapeutic Agents | MERCK SHARP & DOHME (UK) LIMITED (GB) | 2009-11-19 | — | — | US | disclosed |
| EP-1899294-A1 | THERAPEUTIC AGENTS | Merck Sharp & Dohme Limited (GB) | 2008-03-19 | — | — | EP | disclosed |
| WO-2006134341-A1 | THERAPEUTIC AGENTS | MERCK SHARP & DOHME LIMITED (GB) | 2006-12-21 | — | — | WO | disclosed |
| EP-0594263-B1 | INTERMEDIATES FOR THE PREPARATION OF THIOALKYLTHIO CEPHALOSPORIN DERIVATIVES | SHIONOGI & CO (JP) | 1999-06-09 | — | — | EP | disclosed |
| WO-1997041128-A1 | 3-PYRAZOLIOMETHYLCEPHEM COMPOUNDS AS ANTIMICROBIAL AGENTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-11-06 | — | — | WO | disclosed |
| CN-1034504-C | Thioalkylthio cephalosporin derivatives | SHIONOGI & CO (JP) | 1997-04-09 | — | — | CN | disclosed |
| US-5352792-A | Bactericides | SHIONOGI & CO., LTD. (JP) | 1994-10-04 | — | — | US | disclosed |
| EP-0467647-B1 | Thioalkylthio cephalosporin derivatives | SHIONOGI & CO (JP) | 1994-08-17 | — | — | EP | disclosed |
| EP-0467647-A2 | Thioalkylthio cephalosporin derivatives | SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) | 1992-01-22 | — | — | EP | disclosed |
| US-4868294-A | ANTIBIOTICS | BRISTOL-MYERS COMPANY (US) | 1989-09-19 | — | — | US | disclosed |
| EP-0233271-A4 | PROCESS FOR PREPARING CEPHALOSPORIN INTERMEDIATES. | BRISTOL MYERS CO (US) | 1988-10-20 | — | — | EP | disclosed |
| US-4714760-A | ANTIBIOTICS | BRISTOL-MYERS COMPANY (US) | 1987-12-22 | — | — | US | disclosed |
| EP-0233271-A1 | PROCESS FOR PREPARING CEPHALOSPORIN INTERMEDIATES. | BRISTOL MYERS CO (US) | 1987-08-26 | — | — | EP | disclosed |
| WO-1987001116-A1 | PROCESS FOR PREPARING CEPHALOSPORIN INTERMEDIATES | BRISTOL-MYERS COMPANY (US) | 1987-02-26 | — | — | WO | disclosed |
| EP-0117651-A2 | Process for the preparation of cephalosporins | ICI PHARMA (FR) | 1984-09-05 | — | — | EP | disclosed |
| US-4142046-A | BACTERICIDES, 7-AMINO-CEPHALOSPORINS | SMITHKLINE CORPORATION (US) | 1979-02-27 | — | — | US | disclosed |
| US-4060610-A | Pharmaceutical compositions comprising 7-acyl-3-(substituted triazolyl thiomethyl)-cephalosporins and methods of treating bacterial infections | SMITHKLINE CORPORATION (US) | 1977-11-29 | — | — | US | disclosed |
| US-3989694-A | ANTIBACTERIAL | SMITHKLINE CORPORATION (US) | 1976-11-02 | — | — | US | disclosed |