⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6996638 | 1.00 | — | — | |
| SCHEMBL6650673 | 0.75 | — | — | |
| SCHEMBL11450863 | 0.62 | — | — | |
| SCHEMBL385089 | 0.59 | — | — | |
| SCHEMBL8736620 | 0.59 | — | — | |
| SCHEMBL133545 | 0.53 | — | — | |
| SCHEMBL1574704 | 0.47 | — | — | |
| SCHEMBL105812 | 0.47 | — | — | |
| Hydrochloric Acid SCHEMBL4481966 | 0.47 | — | — | |
| Iodide SCHEMBL6651060 | 0.47 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5753757-A | Electroluminescent polymer compositions and processes thereof | XEROX CORPORATION (US) | 1998-05-19 | — | — | US | claimed |
| US-20140179919-A1 | COMPOUNDS, COMPOSITIONS, METHODS OF SYNTHESIS, AND METHODS OF TREATMENT | EMORY UNIVERSITY (US) | 2014-06-26 | — | — | US | disclosed |
| US-20130287687-A1 | COMPOUNDS, COMPOSITIONS, METHODS OF SYNTHESIS, AND METHODS OF TREATMENT | UNIV EMORY (US) | 2013-10-31 | — | — | US | disclosed |
| US-8551996-B2 | Compounds, compositions, methods of synthesis, and methods of treatment | EMORY UNIVERSITY (US) | 2013-10-08 | — | — | US | disclosed |
| US-20110305636-A1 | COMPOUNDS, COMPOSITIONS, METHODS OF SYNTHESIS, AND METHODS OF TREATMENT | EMORY UNIVERSITY (US) | 2011-12-15 | — | — | US | disclosed |
| EP-0793497-B1 | NOVEL ENEDIYNE QUINONE IMINES AND METHODS OF PREPARATION AND USE THEREOF | SLOAN KETTERING INST CANCER (US) | 2003-02-12 | — | — | EP | disclosed |
| US-6020341-A | Enediyne quinone imines and methods of preparation and use thereof | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2000-02-01 | — | — | US | disclosed |
| US-5753757-A | Electroluminescent polymer compositions and processes thereof | XEROX CORPORATION (US) | 1998-05-19 | — | — | US | disclosed |
| EP-0793497-A4 | NOVEL ENEDIYNE QUINONE IMINES AND METHODS OF PREPARATION AND USE THEREOF | SLOAN KETTERING INST CANCER (US) | 1998-01-28 | — | — | EP | disclosed |
| EP-0793497-A1 | NOVEL ENEDIYNE QUINONE IMINES AND METHODS OF PREPARATION AND USE THEREOF | Sloan-Kettering Institute For Cancer Research (US) | 1997-09-10 | — | — | EP | disclosed |
| US-5622958-A | ANTITUMOR AGENTS, ANTICARCINOGENIC AGENTS | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1997-04-22 | — | — | US | disclosed |
| WO-1996016655-A1 | NOVEL ENEDIYNE QUINONE IMINES AND METHODS OF PREPARATION AND USE THEREOF | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1996-06-06 | — | — | WO | disclosed |