⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10209581 | 0.83 | — | — | |
| SCHEMBL20957494 | 0.79 | — | — | |
| SCHEMBL20957493 | 0.79 | — | — | |
| SCHEMBL8112565 | 0.79 | — | — | |
| SCHEMBL14491757 | 0.79 | — | — | |
| SCHEMBL20573855 | 0.75 | — | — | |
| SCHEMBL20573857 | 0.75 | — | — | |
| SCHEMBL10950880 | 0.75 | — | — | |
| SCHEMBL15801481 | 0.74 | — | — | |
| SCHEMBL12654720 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1222184-A2 | PREPARATION AND USE OF GAMMA-BUTYROLACTONES AS CROSS-LINKING AGENTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2002-07-17 | — | — | EP | disclosed |
| WO-2000078743-A2 | PREPARATION AND USE OF GAMMA-BUTYROLACTONES AS CROSS-LINKING AGENTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-12-28 | — | — | WO | disclosed |