⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28964077 | 0.83 | — | — | |
| SCHEMBL9788479 | 0.82 | — | — | |
| SCHEMBL11272031 | 0.82 | TSHR (0.32) | — | |
| SCHEMBL4478986 | 0.79 | — | — | |
| SCHEMBL127300 | 0.76 | TSHR (0.38) | — | |
| SCHEMBL11619817 | 0.74 | — | — | |
| SCHEMBL4575258 | 0.74 | — | — | |
| SCHEMBL4575265 | 0.74 | — | — | |
| SCHEMBL4845594 | 0.73 | — | — | |
| SCHEMBL4479251 | 0.72 | KMT2A (0.31) | — |
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-2441744-B1 | Acetylenic diol ethylene oxide/propylene oxide adducts and their use | AIR PROD & CHEM (US) | 2013-05-01 | — | — | EP | disclosed |
| EP-1115035-B1 | Acetylenic diol ethylene oxide/propylene oxide adducts and their use in photoresist developers | AIR PROD & CHEM (US) | 2012-10-03 | — | — | EP | disclosed |
| EP-2441744-A1 | Acetylenic diol ethylene oxide/propylene oxide adducts and their use | Air Products and Chemicals, Inc. (US) | 2012-04-18 | — | — | EP | disclosed |
| US-7348300-B2 | Acetylenic diol ethylene oxide/propylene oxide adducts and processes for their manufacture | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2008-03-25 | — | — | US | disclosed |
| US-20050176605-A1 | Acetylenic diol ethylene oxide/propylene oxide adducts and processes for their manufacture | EVONIK DEGUSSA GMBH (DE) | 2005-08-11 | — | — | US | disclosed |
| US-6864395-B2 | Acetylenic diol ethylene oxide/propylene oxide adducts and processes for their manufacture | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2005-03-08 | — | — | US | disclosed |
| US-20040071967-A1 | Microcapsule containing phase-change material and nucleating agent | LEE WON-MOK (KR) | 2004-04-15 | — | — | US | disclosed |
| US-6455234-B1 | REDUCE THE SURFACE TENSION IN WATER-BASED SYSTEMS | AIR PRODUCTS AND CHEMICALS, INC. | 2002-09-24 | — | — | US | disclosed |
| US-20020106589-A1 | Acetylenic diol ethylene oxide/propylene oxide adducts and their use in photoresist developers | EVONIK DEGUSSA GMBH (DE) | 2002-08-08 | — | — | US | disclosed |
| US-20020055660-A1 | Acetylenic diol ethylene oxide/propylene oxide adducts and processes for their manufacture | EVONIK OPERATIONS GMBH (DE) | 2002-05-09 | — | — | US | disclosed |
| US-6313182-B1 | APPLYING A WATER-BASED COATING COMPRISING ORGANIC OR INORGANIC COMPOUND AND SURFACTANT FOR REDUCING SURFACE TENSION OF FORMULATION TO PARTIALLY OR FULLY COAT THE SURFACE | AIR PRODUCTS AND CHEMICALS, INC. | 2001-11-06 | — | — | US | disclosed |
| EP-1115035-A1 | Acetylenic diol ethylene oxide/propylene oxide adducts and their use in photoresist developers | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2001-07-11 | — | — | EP | disclosed |