⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9518275 | 1.00 | — | — | |
| SCHEMBL9518282 | 1.00 | — | — | |
| SCHEMBL3004113 | 0.74 | — | — | |
| SCHEMBL142566 | 0.67 | — | — | |
| SCHEMBL3695411 | 0.67 | — | — | |
| SCHEMBL8176834 | 0.67 | — | — | |
| SCHEMBL13028516 | 0.67 | — | — | |
| Chloromethane SCHEMBL10458728 | 0.57 | — | — | |
| Hypochlorous Acid SCHEMBL9444710 | 0.57 | — | — | |
| Methyl Alcohol SCHEMBL27398618 | 0.57 | — | — |
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 |