⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL871284 | 0.65 | — | — | |
| SCHEMBL28726338 | 0.65 | — | — | |
| SCHEMBL8429834 | 0.64 | — | — | |
| SCHEMBL5855312 | 0.62 | — | — | |
| SCHEMBL5855303 | 0.62 | — | — | |
| SCHEMBL8654085 | 0.62 | — | — | |
| SCHEMBL3482160 | 0.62 | — | — | |
| SCHEMBL3482232 | 0.62 | — | — | |
| SCHEMBL37295 | 0.61 | — | — | |
| SCHEMBL37294 | 0.61 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1877839-A2 | THERMOSETTING POLY(THIO)URETHANE FORMULATION COMPRISING AT LEAST ONE BLOCK COPOLYMER AND USE THEREOF IN OPTICS FOR THE PRODUCTION OF ORGANIC LENSES HAVING IMPROVED TOUGHNESS | ESSILOR INTERNATIONAL Compagnie Générale d'Optique (FR) | 2008-01-16 | — | — | EP | disclosed |
| WO-2006103371-A2 | THERMOSETTING POLY(THIO)URETHANE FORMULATION COMPRISING AT LEAST ONE BLOCK COPOLYMER AND USE THEREOF IN OPTICS FOR THE PRODUCTION OF ORGANIC LENSES HAVING IMPROVED TOUGHNESS | ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) | 2006-10-05 | — | — | WO | disclosed |