⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2005547 | 0.79 | — | — | |
| SCHEMBL10403499 | 0.76 | — | — | |
| SCHEMBL11159092 | 0.76 | ALDH1A1 (0.60) | — | |
| SCHEMBL4551080 | 0.73 | ALDH1A1 (0.56) | — | |
| SCHEMBL4551571 | 0.70 | MEN1 (0.42) | — | |
| Ammonia Solution, Strong SCHEMBL28914391 | 0.67 | — | — | |
| SCHEMBL9572829 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL1291958 | 0.67 | ALPG (0.49) | — | |
| SCHEMBL13219770 | 0.67 | — | — | |
| SCHEMBL29061272 | 0.65 | — | — |
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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024030121-A1 | SMALL-MOLECULE ACTIVATORS OF MYCOBACTERIUM TUBERCULOSIS ADENYLYL CYCLASE | THE SCRIPPS RESEARCH INSTITUTE (US) | 2024-02-08 | — | — | WO | claimed |
| CN-114805462-B | Steroid derivative regulator and preparation method and application thereof | 江苏豪森药业集团有限公司 | 2024-06-18 | — | — | CN | disclosed |
| CN-114656514-B | Steroid derivative regulator and preparation method and application thereof | 江苏豪森药业集团有限公司 | 2024-05-14 | — | — | CN | disclosed |
| WO-2024030121-A1 | SMALL-MOLECULE ACTIVATORS OF MYCOBACTERIUM TUBERCULOSIS ADENYLYL CYCLASE | THE SCRIPPS RESEARCH INSTITUTE (US) | 2024-02-08 | — | — | WO | disclosed |
| CN-112638928-B | Salt of steroid derivative regulator and crystal form thereof | 上海翰森生物医药科技有限公司 | 2023-12-22 | — | — | CN | disclosed |
| EP-3430013-B1 | CARBAPENEM COMPOUNDS | ORCHID PHARMA LTD (IN) | 2023-11-15 | — | — | EP | disclosed |
| CN-114085260-B | Steroid derivative regulator, preparation method and application thereof | 江苏豪森药业集团有限公司 | 2023-10-20 | — | — | CN | disclosed |
| CN-113999277-B | Steroid derivative regulator, preparation method and application thereof | 江苏豪森药业集团有限公司 | 2023-08-29 | — | — | CN | disclosed |
| CN-114085260-A | Steroid derivative regulator, preparation method and application thereof | 江苏豪森药业集团有限公司 | 2022-02-25 | — | — | CN | disclosed |
| EP-3095780-A1 | PESTICIDAL ARYLPYRROLIDINES | Bayer Intellectual Property GmbH (DE) | 2016-11-23 | — | — | EP | disclosed |
| US-20110046103-A1 | Neurotherapeutic Cephalosporin Sulfoxide and Sulfone-Containing Compositions | REVAAX PHARMACEUTICALS, LLC (US) | 2011-02-24 | — | — | US | disclosed |
| US-20110046103-A1 | Neurotherapeutic Cephalosporin Sulfoxide and Sulfone-Containing Compositions | REVAAX PHARMACEUTICALS, LLC (US) | 2011-02-24 | — | — | US | disclosed |
| US-7833998-B2 | Oral neurotherapeutic cephalosporin sulfoxide and sulfone-containing compositions | REVAAX PHARMACEUTICALS, LLC (US) | 2010-11-16 | — | — | US | disclosed |
| US-7833998-B2 | Oral neurotherapeutic cephalosporin sulfoxide and sulfone-containing compositions | REVAAX PHARMACEUTICALS, LLC (US) | 2010-11-16 | — | — | US | disclosed |
| US-20100216792-A1 | Pesticidal arylpyrrolidines | BAYER CROPSCIENCE AG (DE) | 2010-08-26 | — | — | US | disclosed |
| US-20080176825-A1 | Oral Neurotherapeutic Cefazolin Compositons | REVAAX PHARMACEUTICALS, LLC | 2008-07-24 | — | — | US | disclosed |
| US-20080176825-A1 | Oral Neurotherapeutic Cefazolin Compositons | REVAAX PHARMACEUTICALS, LLC | 2008-07-24 | — | — | US | disclosed |
| EP-1294724-B1 | PYRROLO¬2,3-D|PYRIMIDINE COMPOUNDS AS IMMUNOSUPPRESSIVE AGENTS | PFIZER PROD INC (US) | 2006-04-19 | — | — | EP | disclosed |
| CN-1024011-C | Process for producing cephalosporin compound | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1994-03-16 | — | — | CN | disclosed |
| CN-87101581-A | Process for producing cephalosporin compound | — | 1987-09-30 | — | — | CN | disclosed |