⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9719988 | 0.65 | — | — | |
| SCHEMBL31091494 | 0.62 | — | — | |
| Bicarbonate SCHEMBL9021097 | 0.57 | — | — | |
| SCHEMBL8415036 | 0.55 | — | — | |
| SCHEMBL31296072 | 0.55 | TSHR (0.30) | — | |
| Benzene SCHEMBL28206049 | 0.54 | — | — | |
| SCHEMBL23833213 | 0.52 | — | — | |
| SCHEMBL23833208 | 0.52 | — | — | |
| SCHEMBL9872265 | 0.52 | MAOA (0.32) | — | |
| Benzene SCHEMBL27769371 | 0.51 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9475777-B2 | Thermally robust, highly porous, and partially fluorinated organic framework with affinity for hydrocarbons, fluorocarbons and freons | UNIVERSITY OF HOUSTON SYSTEM (US) | 2016-10-25 | — | — | US | disclosed |
| CN-105579127-A | Aldehyde removal material | TOYO BOSEKI | 2016-05-11 | — | — | CN | disclosed |
| US-20150329492-A1 | THERMALLY ROBUST, HIGHLY POROUS, AND PARTIALLY FLUORINATED ORGANIC FRAMEWORK WITH AFFINITY FOR HYDROCARBONS, FLUOROCARBONS AND FREONS | UNIVERSITY OF HOUSTON SYSTEM (US) | 2015-11-19 | — | — | US | disclosed |
| WO-2015175348-A1 | THERMALLY ROBUST, HIGHLY POROUS, AND PARTIALLY FLUORINATED ORGANIC FRAMEWORK WITH AFFINITY FOR HYDROCARBONS, FLUOROCARBONS AND FREONS | UNIVERSITY OF HOUSTON SYSTEM (US) | 2015-11-19 | — | — | WO | disclosed |