⚠ 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 | |
|---|---|---|---|---|
| Isothiocyanate SCHEMBL4002 | 1.00 | — | — | |
| Isothiocyanate SCHEMBL133963 | 1.00 | — | — | |
| Isothiocyanate SCHEMBL8940171 | 1.00 | ALDH1A1 (0.43) | — | |
| Isothiocyanate SCHEMBL331891 | 0.93 | ALDH1A1 (0.38) | — | |
| Isothiocyanate SCHEMBL550842 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL20183932 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL191111 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL1534323 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL6013846 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL22204423 | 0.93 | — | — |
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 84 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023186966-A1 | LATE-STAGE CATALYSIS OF FAST ROOM-TEMPERATURE POLYMERIZATIONS | ESSILOR INTERNATIONAL (FR) | 2023-10-05 | — | — | WO | claimed |
| EP-4253019-A1 | LATE-STAGE CATALYSIS OF FAST ROOM-TEMPERATURE POLYMERIZATIONS | Essilor International (FR) | 2023-10-04 | — | — | EP | claimed |
| JP-4512090-B2 | — | — | 2010-07-28 | — | — | JP | claimed |
| EP-1608704-B1 | THIOPHOSPHINE COMPOUNDS AND METHOD OF MAKING POLYMERISABLE COMPOSITIONS CONTAINING THEM AND THEIR USE FOR MAKING OPHTALMIC LENSES | ESSILOR INT (FR) | 2008-03-19 | — | — | EP | claimed |
| EP-1448650-B1 | METHOD FOR MAKING TRANSPARENT POLYTHIOURETHANE SUBSTRATES IN PARTICULAR OPTICAL SUBSTRATES | ESSILOR INT (FR) | 2006-11-08 | — | — | EP | claimed |
| US-7129321-B2 | Thiophosphine compounds and methods of making polymerizable compositions containing them and their use for making ophthalmic lenses | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 2006-10-31 | — | — | US | claimed |
| JP-2006521437-A | — | — | 2006-09-21 | — | — | JP | claimed |
| US-20060115682-A1 | Hole or electron injection polymers and prepolymers, hole or electron transport polymers and prepolymers, method for forming the same, and their application | NATIONAL TAIWAN UNIVERSITY (TW) | 2006-06-01 | — | — | US | claimed |
| EP-1608704-A2 | THIOPHOSPHINE COMPOUNDS AND METHOD OF MAKING POLYMERISABLE COMPOSITIONS CONTAINING THEM AND THEIR USE FOR MAKING OPHTALMIC LENSES | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 2005-12-28 | — | — | EP | claimed |
| US-20050107579-A1 | Thiophosphine compounds and methods of making polymerizable compositions containing them and their use for making ophthalmic lenses | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 2005-05-19 | — | — | US | claimed |
| US-6887401-B2 | Method for making transparent polythiourethane substrates in particular optical substrates | ESSILOR INTERNATIONAL COMPAGNIE GENERAL D'OPTIQUE (FR) | 2005-05-03 | — | — | US | claimed |
| WO-2004085447-A2 | THIOPHOSPHINE COMPOUNDS AND METHOD OF MAKING POLYMERISABLE COMPOSITIONS CONTAINING THEM AND THEIR USE FOR MAKING OPHTALMIC LENSES | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 2004-10-07 | — | — | WO | claimed |
| EP-1448650-A1 | METHOD FOR MAKING TRANSPARENT POLYTHIOURETHANE SUBSTRATES IN PARTICULAR OPTICAL SUBSTRATES | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 2004-08-25 | — | — | EP | claimed |
| US-20030125410-A1 | Method for making transparent polythiourethane substrates in particular optical substrates | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE | 2003-07-03 | — | — | US | claimed |
| WO-2003040205-A1 | METHOD FOR MAKING TRANSPARENT POLYTHIOURETHANE SUBSTRATES IN PARTICULAR OPTICAL SUBSTRATES | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 2003-05-15 | — | — | WO | claimed |
| US-5194499-A | Polymerizing diene block copolymer in presence of rubber | BRIDGESTONE/FIRESTONE, INC. (US) | 1993-03-16 | — | — | US | claimed |
| EP-0137104-B1 | IMPROVED PROCESS FOR PREPARING FREE FLOWING POLYMER PELLETS | THE FIRESTONE TIRE & RUBBER COMPANY (US) | 1988-08-17 | — | — | EP | claimed |
| EP-0137104-A2 | Improved process for preparing free flowing polymer pellets | THE FIRESTONE TIRE & RUBBER COMPANY (US) | 1985-04-17 | — | — | EP | claimed |
| WO-2024145346-A1 | CHROMOPHORIC COMPOUNDS AND UV-ABSORBING COMPOSITIONS | LYGG CORPORATION (US) | 2024-07-04 | — | — | WO | disclosed |
| WO-1989011868-A1 | MACROCYCLIC COMPLEXES OF YTTRIUM, THE LANTHANIDES AND THE ACTINIDES HAVING PERIPHERAL COUPLING FUNCTIONALITIES | COULTER ELECTRONICS, INC. (US) | 1989-12-14 | — | — | WO | disclosed |