⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4829929 | 0.70 | — | — | |
| SCHEMBL515193 | 0.70 | — | — | |
| SCHEMBL11294895 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL7940945 | 0.70 | — | — | |
| SCHEMBL1492004 | 0.70 | THRB (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL4917394 | 0.67 | — | — | |
| SCHEMBL7722051 | 0.67 | — | — | |
| SCHEMBL1147760 | 0.67 | — | — | |
| SCHEMBL14306860 | 0.67 | — | — | |
| SCHEMBL8086513 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2807174-B1 | MOLYBDENUM ALLYL COMPLEXES AND USE THEREOF IN THIN FILM DEPOSITION | SIGMA ALDRICH CO LLC (US) | 2016-03-30 | — | — | EP | disclosed |
| US-20150344404-A1 | PDK4 INHIBITOR AND USE THEREOF | THE KITASATO INSTITUTE (JP) | 2015-12-03 | — | — | US | disclosed |
| EP-2939668-A1 | PDK4 INHIBITOR AND USE THEREOF | The Kitasato Institute (JP) | 2015-11-04 | — | — | EP | disclosed |
| EP-2807174-A1 | MOLYBDENUM ALLYL COMPLEXES AND USE THEREOF IN THIN FILM DEPOSITION | Sigma Aldrich Co. LLC (US) | 2014-12-03 | — | — | EP | disclosed |
| WO-2013112383-A1 | MOLYBDENUM ALLYL COMPLEXES AND USE THEREOF IN THIN FILM DEPOSITION | SIGMA-ALDRICH CO. LLC (US) | 2013-08-01 | — | — | WO | disclosed |
| US-20120029219-A1 | LOW ZIRCONIUM, HAFNIUM-CONTAINING COMPOSITIONS, PROCESSES FOR THE PREPARATION THEREOF AND METHODS OF USE THEREOF | PRAXAIR TECHNOLOGY, INC. | 2012-02-02 | — | — | US | disclosed |
| US-20060193979-A1 | Low zirconium, hafnium-containing compositions, processes for the preparation thereof and methods of use thereof | PRAXAIR TECHNOLOGY, INC. | 2006-08-31 | — | — | US | disclosed |
| US-20060062910-A1 | Low zirconium, hafnium-containing compositions, processes for the preparation thereof and methods of use thereof | PRAXAIR TECHNOLOGY, INC. | 2006-03-23 | — | — | US | disclosed |
| CN-1151769-C | Hair cosmetic composition | ������ѧ��ʽ���� | 2004-06-02 | — | — | CN | disclosed |
| CN-1176094-A | Hair cosmetic composition | MITSUBISHI CHEM CORP (JP) | 1998-03-18 | — | — | CN | disclosed |
| US-4444929-A | Unsymmetrical phosphite-phenolic isocyanurate stabilizer combinations | THE B. F. GOODRICH COMPANY (US) | 1984-04-24 | — | — | US | disclosed |