⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL220819 | 0.97 | — | — | |
| SCHEMBL3696669 | 0.94 | — | — | |
| SCHEMBL3759119 | 0.94 | — | — | |
| SCHEMBL27553224 | 0.94 | — | — | |
| SCHEMBL11311561 | 0.94 | ALDH1A1 (0.41) | — | |
| Benzene SCHEMBL28198819 | 0.88 | FFAR3 (0.40) | — | |
| SCHEMBL4573923 | 0.88 | — | — | |
| SCHEMBL9307187 | 0.86 | ALDH1A1 (0.36) | — | |
| SCHEMBL1170200 | 0.84 | NAAA (0.58) | — | |
| Octane SCHEMBL29098191 | 0.84 | NAAA (0.58) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1524289-B1 | POLYMERIZABLE COMPOSITION, OPTICAL MATERIAL COMPRISING THE COMPOSITION AND METHOD FOR PRODUCING THE MATERIAL | MITSUBISHI GAS CHEMICAL CO (JP) | 2009-09-16 | — | — | EP | disclosed |
| US-20070149639-A1 | Polymerizable composition, optical material comprising the composition and method for producing the material | HORIKOSHI HIROSHI | 2007-06-28 | — | — | US | disclosed |
| EP-1524289-A1 | POLYMERIZABLE COMPOSITION, OPTICAL MATERIAL COMPRISING THE COMPOSITION AND METHOD FOR PRODUCING THE MATERIAL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2005-04-20 | — | — | EP | disclosed |
| US-20040254258-A1 | Polymerizable composition, optical material comprising the composition and method for producing the material | MITSUBISHI GAS CHEMICAL CO., LTD. (JP) | 2004-12-16 | — | — | US | disclosed |
| US-6224981-B1 | Water-redispersible powders of film-forming polymers having a core/shell structure | RHODIA CHIMI (FR) | 2001-05-01 | — | — | US | disclosed |
| EP-0801659-B1 | WATER REDISPERSIBLE POWDERS OF FILM-FORMING POLYMERS WITH A CORE/SHELL STRUCTURE | RHODIA CHIMIE SA (FR) | 1999-03-10 | — | — | EP | disclosed |
| US-5872189-A | PREPARATION OF PAPER-COATING COMPOSITIONS, PAINT COMPOSITIONS, ADHESIVE COATINGS (PRESSURE-SENSITIVE ADHESIVES, TILING ADHESIVES) AND ADDITIVES TO HYDRAULIC BINDERS OF THE MORTAR OR CONCRETE TYPE | RHONE-POULENC CHIMIE (FR) | 1999-02-16 | — | — | US | disclosed |
| EP-0801659-A1 | WATER REDISPERSIBLE POWDERS OF FILM-FORMING POLYMERS WITH A CORE/SHELL STRUCTURE | RHONE-POULENC CHIMIE (FR) | 1997-10-22 | — | — | EP | disclosed |
| WO-1996020963-A1 | WATER REDISPERSIBLE POWDERS OF FILM-FORMING POLYMERS WITH A CORE/SHELL STRUCTURE | RHONE-POULENC CHIMIE (FR) | 1996-07-11 | — | — | WO | disclosed |