⚠ 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 | |
|---|---|---|---|---|
| Dl-Dithiothreitol SCHEMBL28303162 | 0.87 | LMNA (0.33) | — | |
| SCHEMBL16705461 | 0.76 | — | — | |
| SCHEMBL790474 | 0.76 | — | — | |
| SCHEMBL13715418 | 0.76 | — | — | |
| SCHEMBL8535725 | 0.76 | — | — | |
| SCHEMBL6665918 | 0.75 | — | — | |
| Dl-Dithiothreitol SCHEMBL28388554 | 0.74 | LMNA (0.39) | — | |
| Dithiothreitol SCHEMBL538995 | 0.73 | — | — | |
| Dl-Dithiothreitol SCHEMBL14496668 | 0.73 | — | — | |
| Dl-Dithiothreitol SCHEMBL21114400 | 0.73 | LMNA (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1057843-B1 | Aqueous emulsion, process for producing the same and aqueous paint and aqueous printing ink comprising the same | NIPPON POLYURETHANE KOGYO KK (JP) | 2004-09-15 | — | — | EP | disclosed |
| EP-0742244-B1 | Durable polysulfide composition for optical material | MITSUI CHEMICALS INC (JP) | 2004-08-11 | — | — | EP | disclosed |
| EP-0751161-B1 | Sulfur-containing urethane-based resin composition, optical element and lens comprising this resin | MITSUI CHEMICALS INC (JP) | 2003-01-02 | — | — | EP | disclosed |
| CN-1090654-C | Resin composition based on polysulfide, resin based on polysulfide, and optical material containing said resin | MITSUI TOATSU CHEMICALS K K (JP) | 2002-09-11 | — | — | CN | disclosed |
| US-6306947-B1 | Printing ink and paint composed of an aqueous emulsion of self-emulsifiable urethane copolymer | NIPPON POLYURETHANE INDUSTRY CO., LTD. (JP) | 2001-10-23 | — | — | US | disclosed |
| EP-1057843-A1 | Aqueous emulsion, process for producing the same and aqueous paint and aqueous printing ink comprising the same | NIPPON POLYURETHANE INDUSTRY CO. LTD. (JP) | 2000-12-06 | — | — | EP | disclosed |
| US-5955206-A | POLYTHIOETHERS AND ACRYLATE OR VINYL GROUPS FOR CURING TO FORM OPTICAL LENSES | MITSUI CHEMICALS, INC. (JP) | 1999-09-21 | — | — | US | disclosed |
| US-5736609-A | A POLYTHIO COMPOUND CONTAINING AT LEAST TWO MERCAPTO GROUPS, A POLYISO(THIO)CYANATE COMPOUND, AND A COMPOUND HAVING TWO OR MORE UNSATURATED REACTIVE GROUPS | MITSUI TOATSU CHEMICALS, INC. (JP) | 1998-04-07 | — | — | US | disclosed |
| CN-1154983-A | Resin composition based on polysulfide, resin based on polysulfide, and optical material containing said resin | MITSUI TOATSU CHEMICALS K K (JP) | 1997-07-23 | — | — | CN | disclosed |
| CN-1148055-A | Sulfur-containing urethane-based resin composition, its resin, and optical element and lens comprising resin thereof | MITSUI TOATSU CHEMICALS (JP) | 1997-04-23 | — | — | CN | disclosed |
| EP-0751161-A2 | Sulfur-containing urethane-based resin composition, optical element and lens comprising this resin | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1997-01-02 | — | — | EP | disclosed |
| EP-0742244-A2 | Durable polysulfide composition for optical material | MITSUI TOATSU CHEMICALS, INC. (JP) | 1996-11-13 | — | — | EP | disclosed |