⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13696652 | 0.87 | PHGDH (0.59) | — | |
| SCHEMBL14391456 | 0.83 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL27605000 | 0.72 | — | — | |
| SCHEMBL7984605 | 0.69 | — | — | |
| SCHEMBL4274519 | 0.65 | FAAH (0.38) | — | |
| SCHEMBL4274516 | 0.65 | FAAH (0.38) | — | |
| SCHEMBL37535 | 0.64 | — | — | |
| SCHEMBL896947 | 0.63 | — | — | |
| SCHEMBL14712212 | 0.63 | — | — | |
| SCHEMBL5506106 | 0.63 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3003321-A2 | USE OF DIANHYDROGALACTITOL AND ANALOGS AND DERIVATIVES THEREOF TO TREAT RECURRENT MALIGNANT GLIOMA OR PROGRESSIVE SECONDARY BRIAN TUMOR | Del Mar Pharmaceuticals (CA) | 2016-04-13 | — | — | EP | disclosed |
| WO-2014194312-A2 | USE OF DIANHYDROGALACTITOL AND ANALOGS AND DERIVATIVES THEREOF TO TREAT RECURRENT MALIGNANT GLIOMA OR PROGRESSIVE SECONDARY BRIAN TUMOR | DEL MAR PHARMACEUTICALS (CA) | 2014-12-04 | — | — | WO | disclosed |
| CN-102026625-A | Dithiocarbamate metal chelates and methods of making and using thereof | UNIV UTAH RES FOUND | 2011-04-20 | — | — | CN | disclosed |
| EP-1328267-A4 | METHOD OF TREATING CANCER USING DITHIOCARBAMATE DERIVATIVES | CHARLOTTE MECKLENBURG HOSPITAL (US) | 2006-03-22 | — | — | EP | disclosed |
| WO-2006023714-A2 | DITHIOCARBAMATE DERIVATIVES AND THEIR USE FOR TREATING CANCER | AAIPHARMA INC. (US) | 2006-03-02 | — | — | WO | disclosed |
| EP-1328267-A2 | METHOD OF TREATING CANCER USING DITHIOCARBAMATE DERIVATIVES | Charlotte-Mecklenburg Hospital Authority doing business as Carolinas Medical Center (US) | 2003-07-23 | — | — | EP | disclosed |
| WO-2002028349-A2 | METHOD OF TREATING CANCER USING DITHIOCARBAMATE DERIVATIVES | CHARLOTTE-MECKLENBURG HOSPITAL AUTHORITY, DOING BUSINESS AS CAROLINAS MEDICAL CENTER (US) | 2002-04-11 | — | — | WO | disclosed |
| WO-1991005571-A1 | METHOD FOR PRODUCING BONE MARROW GROWTH CELL FACTORS | UNIVERSITY OF ROCHESTER (US) | 1991-05-02 | — | — | WO | disclosed |