⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9541663 | 0.98 | NPC1 (0.32) | — | |
| Iodide SCHEMBL3830198 | 0.98 | NPC1 (0.32) | — | |
| SCHEMBL13215505 | 0.76 | — | — | |
| Benzene SCHEMBL9542509 | 0.74 | KDM4E (0.42) | — | |
| Iodide SCHEMBL5366846 | 0.74 | KDM4E (0.42) | — | |
| Bromide SCHEMBL11484493 | 0.74 | NPC1 (0.41) | — | |
| SCHEMBL6162141 | 0.73 | CYP2D6 (0.47) | — | |
| SCHEMBL31130749 | 0.73 | CYP2D6 (0.47) | — | |
| Bromide SCHEMBL571679 | 0.71 | CYP2D6 (0.46) | — | |
| Bromide SCHEMBL6697756 | 0.71 | CYP2D6 (0.46) | — |
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 119 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9290515-B2 | Cephem derivative having catechol group | SHIONOGI & CO., LTD (JP) | 2016-03-22 | — | — | US | disclosed |
| US-20140256697-A1 | CEPHEM DERIVATIVE HAVING CATECHOL GROUP | SHIONOGI & CO., LTD. (JP) | 2014-09-11 | — | — | US | disclosed |
| US-20120059008-A1 | DIALKYLAMINO ALKYL ESTERS OF PIVAGABINE AS MEDICAMENTS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS | CENERX BIOPHARMA, INC. (US) | 2012-03-08 | — | — | US | disclosed |
| US-8080548-B2 | Dialkylamino alkyl esters of pivagabine as medicaments for the treatment of central nervous system disorders | CENERX BIOPHARMA, INC. (US) | 2011-12-20 | — | — | US | disclosed |
| US-20100099678-A1 | DIALKYLAMINO ALKYL ESTERS OF PIVAGABINE AS MEDICAMENTS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS | CENERX BIOPHARMA (US) | 2010-04-22 | — | — | US | disclosed |
| US-7696354-B2 | Cephem compounds having broad antibacterial spectrum | SHIONOGI & CO., LTD. (JP) | 2010-04-13 | — | — | US | disclosed |
| US-7632836-B2 | Dialkylamino alkyl esters of pivagabine as medicaments for the treatment of central nervous system disorders | CENERX BIOPHARMA, INC. (US) | 2009-12-15 | — | — | US | disclosed |
| EP-2101585-A1 | DIALKYLAMINO ALKYL ESTERS OF PIVAGABINE AS MEDICAMENTS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS | Cenerx Biopharma, Inc. (US) | 2009-09-23 | — | — | EP | disclosed |
| EP-2080765-A1 | Phosphonocephem Derivates, Their Production And Use | Takeda Pharmaceutical Company Limited (JP) | 2009-07-22 | — | — | EP | disclosed |
| US-20090131655-A1 | Cephem Compounds Having Broad Antibacterial Spectrum | SHIONOGI & CO., LTD. | 2009-05-21 | — | — | US | disclosed |
| US-4430499-A | 7-[2-(2-Aminooxazol-4-yl)-2-(oximino)acetamido]cephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1984-02-07 | — | — | US | disclosed |
| US-4380541-A | 2-AMINO THIAZOL-4-YL- | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1983-04-19 | — | — | US | disclosed |
| EP-0006011-B1 | CEPHALOSPORINS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Takeda Chemical Industries, Ltd. (JP) | 1983-04-06 | — | — | EP | disclosed |
| US-4278671-A | ANTIBIOTICS, BACTERICIDES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1981-07-14 | — | — | US | disclosed |
| US-4264595-A | BACTERICIDES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1981-04-28 | — | — | US | disclosed |
| US-4238608-A | ANTIBIOTICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1980-12-09 | — | — | US | disclosed |
| US-4200575-A | 7[(2-Thiazolyl)-2-(oxoimino)acetamido]cephalosporin derivatives | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1980-04-29 | — | — | US | disclosed |
| US-4197298-A | [3-Heterocyclic-7-(2-methoxyimino-2-aminothiazolyl) acetamido]cephalosporins | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1980-04-08 | — | — | US | disclosed |
| US-4179502-A | 7[2-Hydroxyiminoacetamido]cephalosporins | MINAMIDA ISAO (JP) | 1979-12-18 | — | — | US | disclosed |
| EP-0006011-A1 | Cephalosporins and pharmaceutical compositions containing them | Takeda Chemical Industries, Ltd. (JP) | 1979-12-12 | — | — | EP | disclosed |