⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11848593 | 0.75 | — | — | |
| SCHEMBL13167841 | 0.68 | — | — | |
| SCHEMBL4213559 | 0.67 | TTR (0.33) | — | |
| SCHEMBL11624614 | 0.67 | ALDH1A1 (0.34) | — | |
| SCHEMBL15233747 | 0.64 | ALDH1A1 (0.37) | — | |
| SCHEMBL8699912 | 0.63 | NOS3 (0.31) | — | |
| SCHEMBL4547136 | 0.63 | — | — | |
| SCHEMBL4038167 | 0.63 | — | — | |
| SCHEMBL3613890 | 0.63 | — | — | |
| SCHEMBL4330824 | 0.63 | — | — |
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-8212083-B2 | Use in PEGylation of biologicals; variety of terminal functional groups; made by polymerizing ethylene oxide on initiators such as N-(hydroxyalkyl) imines or N,N-bis(diphenyloxophosphino)-N-hydroxyalkylamines | INTEZYNE TECHNOLOGIES, INC. (US) | 2012-07-03 | — | — | US | disclosed |
| US-20080188638-A1 | Heterobifunctional poly(ethyleneglycol) containing acid-labile amino protecting groups and uses thereof | INTEZYNE TECHNOLOGIES (US) | 2008-08-07 | — | — | US | disclosed |
| EP-0902028-A1 | Tetrazoline herbicides | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1999-03-17 | — | — | EP | disclosed |
| WO-1998035961-A1 | HERBICIDAL TETRAZOLINONES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1998-08-20 | — | — | WO | disclosed |