⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4952330 | 0.85 | CES2 (0.32) | — | |
| SCHEMBL25148114 | 0.82 | MEN1 (0.35) | — | |
| SCHEMBL871278 | 0.82 | MEN1 (0.35) | — | |
| SCHEMBL2262348 | 0.78 | — | — | |
| SCHEMBL77327 | 0.78 | — | — | |
| Di(Hydroxyethyl)Ether SCHEMBL2426061 | 0.77 | TSHR (0.62) | — | |
| Di(Hydroxyethyl)Ether SCHEMBL4961551 | 0.77 | TSHR (0.62) | — | |
| SCHEMBL1770118 | 0.77 | — | — | |
| SCHEMBL21633910 | 0.76 | — | — | |
| SCHEMBL4952337 | 0.76 | TSHR (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8404222-B2 | Soluble, degradable poly(ethylene glycol) derivatives for controllable release of bound molecules into solution | NEKTAR THERAPEUTICS (US) | 2013-03-26 | — | — | US | disclosed |
| US-20120071627-A1 | Soluble, Degradable Poly(ethylene glycol) Derivatives for Controllable Release of Bound Molecules into Solution | NEKTAR THERAPEUTICS (US) | 2012-03-22 | — | — | US | disclosed |