⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1094260 | 1.00 | — | — | |
| SCHEMBL1092868 | 0.98 | — | — | |
| SCHEMBL1094602 | 0.91 | — | — | |
| SCHEMBL2931346 | 0.91 | — | — | |
| SCHEMBL332196 | 0.91 | — | — | |
| SCHEMBL1094955 | 0.89 | — | — | |
| SCHEMBL29068753 | 0.85 | — | — | |
| SCHEMBL6986362 | 0.84 | — | — | |
| SCHEMBL20976717 | 0.83 | — | — | |
| SCHEMBL6901562 | 0.82 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0742244-B1 | Durable polysulfide composition for optical material | MITSUI CHEMICALS INC (JP) | 2004-08-11 | — | — | EP | disclosed |
| EP-0963389-B1 | PHOTOPOLYMERISABLE COMPOSITION BASED ON POLYISO(THIO)CYANATE MONOMERS AND MONOMERS WITH LABILE PROTON, COMPRISING A PHOTOINITIATOR AND AN AGENT ACTIVATING POLYMERISATION AND RESULTING OPTICAL ARTICLES | ESSILOR INT (FR) | 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 |
| US-6225021-B1 | PHOSPHINES AND PHOSPHORUS HALIDES AS CATALYSTS, LENSES, | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D 'OPTIQUE (FR) | 2001-05-01 | — | — | US | disclosed |
| EP-0963389-A1 | PHOTOPOLYMERISABLE COMPOSITION BASED ON POLYISO(THIO)CYANATE MONOMERS AND MONOMERS WITH LABILE PROTON, COMPRISING A PHOTOINITATOR AND AN AGENT ACTIVATING POLYMERISATION AND RESULTING OPTICAL ARTICLES | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 1999-12-15 | — | — | 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 |
| WO-1999033892-A1 | PHOTOPOLYMERISABLE COMPOSITION BASED ON POLYISO(THIO)CYANATE MONOMERS AND MONOMERS WITH LABILE PROTON, COMPRISING A PHOTOINITATOR AND AN AGENT ACTIVATING POLYMERISATION AND RESULTING OPTICAL ARTICLES | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 1999-07-08 | — | — | WO | 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 |
| 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 |