⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL2853593 | 0.82 | — | — | |
| Fluoride SCHEMBL27715055 | 0.82 | — | — | |
| Fluoride SCHEMBL28416500 | 0.82 | — | — | |
| SCHEMBL1531408 | 0.82 | — | — | |
| Fluoride SCHEMBL701965 | 0.82 | — | — | |
| Fluoride SCHEMBL5718721 | 0.82 | — | — | |
| SCHEMBL1756122 | 0.82 | — | — | |
| Fluoride SCHEMBL483730 | 0.82 | — | — | |
| Fluoride SCHEMBL3284423 | 0.67 | — | — | |
| Fluoride SCHEMBL16237737 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5432290-A | Fluorination | RHONE-POULENC CHIMIE (FR) | 1995-07-11 | — | — | US | claimed |
| US-20040166781-A1 | Composition for texturing process | SHOWA DENKO K.K. (JP) | 2004-08-26 | — | — | US | disclosed |
| WO-2002076902-A1 | COMPOSITION FOR TEXTURING PROCESS | SHOWA DENKO K.K. (JP) | 2002-10-03 | — | — | WO | disclosed |
| US-5432290-A | Fluorination | RHONE-POULENC CHIMIE (FR) | 1995-07-11 | — | — | US | disclosed |
| US-5432290-A | Fluorination | RHONE-POULENC CHIMIE (FR) | 1995-07-11 | — | — | US | disclosed |