⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6408151 | 1.00 | — | — | |
| SCHEMBL20613799 | 1.00 | — | — | |
| SCHEMBL6408154 | 1.00 | — | — | |
| SCHEMBL26255110 | 1.00 | — | — | |
| SCHEMBL12068263 | 0.77 | — | — | |
| SCHEMBL21648262 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL14799498 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL21469425 | 0.73 | — | — | |
| SCHEMBL18843983 | 0.73 | — | — | |
| SCHEMBL25692484 | 0.73 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6809096-B1 | SUCH AS 11-METHOXY-7H-PYRIDO(4,3,2-DE)(1,7)PHENANTHROLINE-7-ONE; ANTITUMOR AGENTS | LABORATOIRE L. LAFON (FR) | 2004-10-26 | — | — | US | disclosed |
| EP-1080090-B1 | ANTITUMOUR 1,5-DIAZAANTHRAQUINONES | UNIV MADRID COMPLUTENSE (ES) | 2004-02-25 | — | — | EP | disclosed |
| US-6525063-B2 | 3,7-dimethyl-1,5-diazaanthraquinone for example | UNIVERSIDAD COMPLUTENSE DE MADRID (ES) | 2003-02-25 | — | — | US | disclosed |
| US-20020099066-A1 | Antitumour 1,5-diazaanthraquinones | UNIVERSIDAD COMPLUTENSE DE MADRID (ES) | 2002-07-25 | — | — | US | disclosed |
| WO-2001017997-A1 | SUBSTITUTED DIAZAANTHRACENE COMPOUNDS HAVING PHARMACEUTICAL UTILITY | DIAZANS LIMITED (CA) | 2001-03-15 | — | — | WO | disclosed |
| EP-1080090-A1 | ANTITUMOUR 1,5-DIAZAANTHRAQUINONES | UNIVERSIDAD COMPLUTENSE DE MADRID (ES) | 2001-03-07 | — | — | EP | disclosed |
| US-5994365-A | BACTERICIDES; FUNGICIDES; ANTITUMOR AGENT | DIAZANS LIMITED (CA) | 1999-11-30 | — | — | US | disclosed |
| WO-1999059996-A1 | ANTITUMOUR 1,5-DIAZAANTHRAQUINONES | UNIVERSIDAD COMPLUTENSE DE MADRID (ES) | 1999-11-25 | — | — | WO | disclosed |
| EP-0680481-B1 | DERIVATES OF AZAANTHRAQUINONE AND AZAXANTHONE, HERBICIDES AND PLANT GROWTH REGULATORS CONTAINING THE SAME | BASF AG (DE) | 1998-04-01 | — | — | EP | disclosed |