⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5033729 | 1.00 | — | — | |
| SCHEMBL5029641 | 0.98 | — | — | |
| SCHEMBL5032006 | 0.97 | — | — | |
| SCHEMBL2681932 | 0.95 | — | — | |
| SCHEMBL5029444 | 0.95 | — | — | |
| SCHEMBL19139068 | 0.88 | — | — | |
| SCHEMBL3794533 | 0.85 | — | — | |
| SCHEMBL6124283 | 0.84 | — | — | |
| SCHEMBL28290031 | 0.78 | NPC1 (0.32) | — | |
| SCHEMBL12486670 | 0.75 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9365441-B2 | Product and method for treatment of soil and groundwater contaminated with pollutants that can be anaerobically bioremediated | BORDEN ROBERT C (US) | 2016-06-14 | — | — | US | claimed |
| US-20150329390-A1 | PRODUCT AND METHOD FOR TREATMENT OF SOIL AND GROUNDWATER CONTAMINATED WITH POLLUTANTS THAT CAN BE ANAEROBICALLY BIOREMEDIATED | BORDEN ROBERT C (US) | 2015-11-19 | — | — | US | claimed |
| US-9365441-B2 | Product and method for treatment of soil and groundwater contaminated with pollutants that can be anaerobically bioremediated | BORDEN ROBERT C (US) | 2016-06-14 | — | — | US | disclosed |
| US-20150329390-A1 | PRODUCT AND METHOD FOR TREATMENT OF SOIL AND GROUNDWATER CONTAMINATED WITH POLLUTANTS THAT CAN BE ANAEROBICALLY BIOREMEDIATED | BORDEN ROBERT C (US) | 2015-11-19 | — | — | US | disclosed |
| US-20100126944-A1 | Treatment of Water Contaminated with Energetic Compounds | U.S. GOVERNMENT AS REPRESENTED BY THE SECRETARY OF THE ARMY | 2010-05-27 | — | — | US | disclosed |
| US-20080032382-A1 | Methods and compositions for degradation of nitroaromatic and nitramine pollutants | UNIVERSITY OF IOWA RESEARCH FOUNDATION | 2008-02-07 | — | — | US | disclosed |
| US-7214509-B2 | Methods and compositions for degradation of nitroaromatic and nitramine pollutants | UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) | 2007-05-08 | — | — | US | disclosed |
| US-20060246555-A1 | Degradation of cyclic nitramines | NATIONAL RESEARCH COUNCIL CANADA (CA) | 2006-11-02 | — | — | US | disclosed |
| US-20050054030-A1 | Methods and compositions for degradation of nitroaromatic and nitramine pollutants | UNIVERSITY OF IOWA RESEARCH FOUNDATION | 2005-03-10 | — | — | US | disclosed |
| WO-2005019136-A2 | METHODS AND COMPOSITIONS FOR DEGRADATION OF NITROAROMATIC AND NITRAMINE POLLUTANTS | UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) | 2005-03-03 | — | — | WO | disclosed |
| WO-2004007028-A1 | DEGRADATION OF CYCLIC NITRAMINES | NATIONAL RESEARCH COUNCIL OF CANADA (CA) | 2004-01-22 | — | — | WO | disclosed |