⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25629785 | 0.80 | — | — | |
| SCHEMBL1145408 | 0.76 | — | — | |
| SCHEMBL11765767 | 0.75 | — | — | |
| SCHEMBL11667152 | 0.75 | — | — | |
| SCHEMBL7835313 | 0.73 | CYP2D6 (0.32) | — | |
| SCHEMBL13934684 | 0.73 | GBA1 (0.30) | — | |
| SCHEMBL9035514 | 0.73 | — | — | |
| SCHEMBL21890778 | 0.70 | — | — | |
| SCHEMBL18733162 | 0.70 | — | — | |
| SCHEMBL22759816 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0345847-B1 | PROCESS FOR THE PREPARATION OF POLYMERS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-08-04 | — | — | EP | disclosed |
| EP-0345847-A1 | Process for the preparation of polymers | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1989-12-13 | — | — | EP | disclosed |