⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4627320 | 0.63 | NFKB1 (0.44) | — | |
| SCHEMBL27648274 | 0.57 | — | — | |
| SCHEMBL2222566 | 0.57 | — | — | |
| SCHEMBL28166935 | 0.57 | — | — | |
| SCHEMBL10455846 | 0.57 | — | — | |
| SCHEMBL8144801 | 0.57 | — | — | |
| SCHEMBL934476 | 0.57 | — | — | |
| SCHEMBL38655889 | 0.57 | — | — | |
| SCHEMBL21650075 | 0.51 | RAB9A (0.33) | — | |
| SCHEMBL1476442 | 0.49 | MEN1 (0.67) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3047008-A1 | LAUNDRY CARE COMPOSITION COMPRISING CARBOXYLATE DYE | The Procter & Gamble Company (US) | 2016-07-27 | — | — | EP | disclosed |
| EP-3046971-A2 | LAUNDRY CARE COMPOSITION COMPRISING CARBOXYLATE DYE | Milliken & Company (US) | 2016-07-27 | — | — | EP | disclosed |
| WO-2015041887-A2 | LAUNDRY CARE COMPOSITION COMPRISING CARBOXYLATE DYE | MILLIKEN & COMPANY (US) | 2015-03-26 | — | — | WO | disclosed |
| WO-2015042086-A1 | LAUNDRY CARE COMPOSITION COMPRISING CARBOXYLATE DYE | THE PROCTER & GAMBLE COMPANY (US) | 2015-03-26 | — | — | WO | disclosed |
| US-6455698-B1 | FOR TREATING CEREBRAL ISCHEMIA OR CEREBRAL INFARCTION RESULTING FROM THROMBOEMBOLIC OR HEMORRHAGIC STROKE, CEREBRAL VASOSPASMS, HYPOGLYCEMIA, CARDIAC ARREST, NEURODEGENERATIVE DISORDERS | WARNER-LAMBERT COMPANY | 2002-09-24 | — | — | US | disclosed |
| US-20020065415-A1 | Conformationally semi-constrained quinoxaline 2,3-diones as neuroprotective agents | KORNBERG BRIAN EDWARD (US) | 2002-05-30 | — | — | US | disclosed |
| US-6340758-B1 | DRUGS AS NEUROPROTECTIVE AGENTS INVENTION MAY ALSO BE USEFUL IN THE TREATMENT OF SCHIZOPHRENIA, EPILEPSY, ANXIETY, PAIN AND DRUG ADDICTION. | WARNER-LAMBERT COMPANY | 2002-01-22 | — | — | US | disclosed |