⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9179020 | 0.91 | — | — | |
| SCHEMBL7058113 | 0.79 | AKR1C3 (0.32) | — | |
| SCHEMBL164963 | 0.77 | — | — | |
| SCHEMBL3685443 | 0.74 | — | — | |
| SCHEMBL1759232 | 0.74 | PTGS1 (0.30) | — | |
| SCHEMBL4957656 | 0.73 | PTGS1 (0.31) | — | |
| SCHEMBL4957663 | 0.73 | DPP4 (0.34) | — | |
| SCHEMBL10713948 | 0.73 | — | — | |
| SCHEMBL17309773 | 0.72 | — | — | |
| SCHEMBL8083660 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2219996-A1 | NOVEL PRECIPITATED SILICIC ACID FOR THICKENING AND GENERATING A THIXOTROPIC BEHAVIOR IN LIQUID SYSTEMS | Evonik Degussa GmbH (DE) | 2010-08-25 | — | — | EP | disclosed |
| WO-2009068379-A1 | NOVEL PRECIPITATED SILICIC ACID FOR THICKENING AND GENERATING A THIXOTROPIC BEHAVIOR IN LIQUID SYSTEMS | EVONIK DEGUSSA GMBH (DE) | 2009-06-04 | — | — | WO | disclosed |