⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7526249 | 1.00 | — | — | |
| SCHEMBL2494984 | 0.75 | — | — | |
| SCHEMBL4409308 | 0.72 | ALOX15 (0.31) | — | |
| SCHEMBL941680 | 0.64 | ALDH1A1 (0.36) | — | |
| SCHEMBL18359189 | 0.61 | ALDH1A1 (0.33) | — | |
| SCHEMBL27856393 | 0.61 | — | — | |
| SCHEMBL675560 | 0.61 | — | — | |
| SCHEMBL574296 | 0.59 | MGAM (0.35) | — | |
| SCHEMBL9070388 | 0.59 | ALDH1A1 (0.32) | — | |
| SCHEMBL736365 | 0.59 | ALDH1A1 (0.32) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1002019-B1 | CURABLE COMPOSITIONS BASED ON FUNCTIONAL POLYSILOXANES | PPG IND OHIO INC (US) | 2002-10-02 | — | — | EP | disclosed |
| EP-1000111-B1 | POLYSILOXANE POLYOLS | PPG IND OHIO INC (US) | 2002-02-06 | — | — | EP | disclosed |
| US-6187863-B1 | POLYETHERSILOXANE COPOLYMERS | PPG INDUSTRIES OHIO, INC. | 2001-02-13 | — | — | US | disclosed |
| EP-1002019-A1 | CURABLE COMPOSITIONS BASED ON FUNCTIONAL POLYSILOXANES | PPG Industries Ohio, Inc. (US) | 2000-05-24 | — | — | EP | disclosed |
| EP-1000111-A1 | POLYSILOXANE POLYOLS | PPG Industries Ohio, Inc. (US) | 2000-05-17 | — | — | EP | disclosed |
| WO-1999006472-A1 | POLYSILOXANE POLYOLS | PPG INDUSTRIES OHIO, INC. (US) | 1999-02-11 | — | — | WO | disclosed |
| WO-1999006487-A1 | CURABLE COMPOSITIONS BASED ON FUNCTIONAL POLYSILOXANES | PPG INDUSTRIES OHIO, INC. (US) | 1999-02-11 | — | — | WO | disclosed |