⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29432886 | 1.00 | — | — | |
| SCHEMBL29379114 | 1.00 | — | — | |
| SCHEMBL29811024 | 1.00 | — | — | |
| SCHEMBL27671045 | 1.00 | — | — | |
| SCHEMBL22531181 | 1.00 | — | — | |
| SCHEMBL32684674 | 1.00 | — | — | |
| SCHEMBL347986 | 1.00 | — | — | |
| SCHEMBL116878 | 0.71 | — | — | |
| Water SCHEMBL38651529 | 0.71 | — | — | |
| Water SCHEMBL787836 | 0.71 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1177239-B1 | DOUBLE METAL CYANIDE CATALYSTS FOR THE PRODUCTION OF POLYETHER POLYOLS | BAYER MATERIALSCIENCE AG (DE) | 2004-12-01 | — | — | EP | disclosed |
| EP-1425098-A1 | DOUBLE METAL CYANIDE CATALYSTS FOR THE PRODUCTION OF POLYETHERPOLYOLS | Bayer MaterialScience AG (DE) | 2004-06-09 | — | — | EP | disclosed |
| EP-1115490-B1 | BIMETALLIC CYANIDE CATALYSTS FOR PRODUCING POLYETHER POLYOLS | BAYER MATERIALSCIENCE AG (DE) | 2004-04-21 | — | — | EP | disclosed |
| WO-2003020422-A1 | DOUBLE METAL CYANIDE CATALYSTS FOR THE PRODUCTION OF POLYETHERPOLYOLS | BAYER MATERIALSCIENCE AG (DE) | 2003-03-13 | — | — | WO | disclosed |
| EP-1256596-A1 | Double metal cyanide catalysts for the production of polyetherpolyols | Bayer Aktiengesellschaft (DE) | 2002-11-13 | — | — | EP | disclosed |
| EP-1177239-A1 | DOUBLE METAL CYANIDE CATALYSTS FOR THE PRODUCTION OF POLYETHER POLYOLS | Bayer Aktiengesellschaft (DE) | 2002-02-06 | — | — | EP | disclosed |
| EP-1115490-A1 | BIMETALLIC CYANIDE CATALYSTS FOR PRODUCING POLYETHER POLYOLS | BAYER AG (DE) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000068295-A1 | DOUBLE METAL CYANIDE CATALYSTS FOR THE PRODUCTION OF POLYETHER POLYOLS | BAYER AKTIENGESELLSCHAFT (DE) | 2000-11-16 | — | — | WO | disclosed |
| WO-2000015337-A1 | BIMETALLIC CYANIDE CATALYSTS FOR PRODUCING POLYETHER POLYOLS | BAYER AKTIENGESELLSCHAFT (DE) | 2000-03-23 | — | — | WO | disclosed |