⚠ 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 | |
|---|---|---|---|---|
| Propane SCHEMBL28287016 | 0.84 | — | — | |
| Ethoxycarbonyl Group SCHEMBL27704872 | 0.81 | LMNA (0.32) | — | |
| SCHEMBL9293 | 0.81 | — | — | |
| SCHEMBL30154499 | 0.81 | TDP1 (0.30) | — | |
| Ethoxycarbonyl Group SCHEMBL453 | 0.81 | — | — | |
| Ethoxycarbonyl Group SCHEMBL1332384 | 0.81 | — | — | |
| Ethoxycarbonyl Group SCHEMBL5306888 | 0.81 | ALDH1A1 (0.38) | — | |
| Ethoxycarbonyl Group SCHEMBL17825894 | 0.79 | — | — | |
| Ethoxycarbonyl Group SCHEMBL5482235 | 0.78 | — | — | |
| Ethoxycarbonyl Group SCHEMBL374751 | 0.78 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2205651-A1 | PHTHALIC ANHYDRIDE BASED POLYESTER-ETHER POLYOLS AND DOUBLE METAL CYANIDE CATALYST SYSTEM FOR PREPARING SAME | STEPAN COMPANY (US) | 2010-07-14 | — | — | EP | disclosed |
| WO-2009055436-A1 | PHTHALIC ANHYDRIDE BASED POLYESTER-ETHER POLYOLS AND DOUBLE METAL CYANIDE CATALYST SYSTEM FOR PREPARING SAME | STEPAN COMPANY (US) | 2009-04-30 | — | — | WO | disclosed |
| US-20080108719-A1 | Phthalic Anhydride Based Polyester-Ether Polyols and Double Metal Cyanide Catalyst System for Preparing Same | GEIGER ERIC J | 2008-05-08 | — | — | US | disclosed |
| US-20060135637-A1 | Phthalic anhydride based polyester-ether polyols and double metal cyanide catalyst system for preparing same | STEPAN COMPANY | 2006-06-22 | — | — | US | disclosed |
| WO-2006060273-A2 | PHTHALIC ANHYDRIDE BASED POLYESTER-ETHER POLYOLS AND DOUBLE METAL CYANIDE CATALYST SYSTEM FOR PREPARING SAME | STEPAN COMPANY (US) | 2006-06-08 | — | — | WO | disclosed |
| US-20050085658-A1 | Phthalic anhydride based polyester-ether polyols and double metal cyanide catalyst system for preparing same | GEIGER ERIC J (US) | 2005-04-21 | — | — | US | disclosed |
| US-6855844-B1 | Phtalic anhydride based polyester-ether polyols and double metal cyanide catalyst system for preparing same | STEPAN COMPANY (US) | 2005-02-15 | — | — | US | disclosed |
| US-4477589-A | Catalysts for the polymerization of epoxides and process for the preparation of such catalysts | SHELL OIL COMPANY (US) | 1984-10-16 | — | — | US | disclosed |