⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11600094 | 0.74 | — | — | |
| SCHEMBL356893 | 0.72 | — | — | |
| SCHEMBL907398 | 0.71 | — | — | |
| SCHEMBL19030878 | 0.70 | — | — | |
| SCHEMBL1983188 | 0.70 | — | — | |
| SCHEMBL3540329 | 0.70 | — | — | |
| SCHEMBL1536249 | 0.70 | — | — | |
| SCHEMBL3277518 | 0.70 | — | — | |
| SCHEMBL162495 | 0.70 | — | — | |
| SCHEMBL1088381 | 0.70 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9994470-B2 | Method of removing recalcitrant organic pollutants | GENERAL ELECTRIC COMPANY (US) | 2018-06-12 | — | — | US | disclosed |
| WO-2017139569-A1 | DEUTERIUM-MODIFIED CFTR MODULATORS | CONCERT PHARMACEUTICALS, INC. (US) | 2017-08-17 | — | — | WO | disclosed |
| EP-2683660-A1 | METHOD OF REMOVING RECALCITRANT ORGANIC POLLUTANT | General Electric Company (US) | 2014-01-15 | — | — | EP | disclosed |
| US-20130334135-A1 | METHOD OF REMOVING RECALCITRANT ORGANIC POLLUTANTS | BL TECHNOLOGIES, INC. | 2013-12-19 | — | — | US | disclosed |
| WO-2012119266-A1 | METHOD OF REMOVING RECALCITRANT ORGANIC POLLUTANT | GENERAL ELECTRIC COMPANY (US) | 2012-09-13 | — | — | WO | disclosed |
| WO-1992017443-A1 | PROCESS FOR PRODUCING 2-ALKYLTHIO-BENZOLE SULPHONIC ACID CHLORIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1992-10-15 | — | — | WO | disclosed |