⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6757124 | 0.75 | — | — | |
| SCHEMBL10940050 | 0.75 | — | — | |
| SCHEMBL5798323 | 0.72 | — | — | |
| SCHEMBL4243461 | 0.70 | ALDH1A1 (0.30) | — | |
| SCHEMBL27608868 | 0.69 | — | — | |
| SCHEMBL11816700 | 0.69 | — | — | |
| SCHEMBL447698 | 0.65 | — | — | |
| SCHEMBL8984539 | 0.65 | — | — | |
| SCHEMBL9246619 | 0.64 | — | — | |
| SCHEMBL28468091 | 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 |
|---|---|---|---|---|---|---|---|
| JP-10219049-A | — | — | None | — | — | JP | disclosed |
| US-20130090477-A1 | Thiazolylpiperidine Derivatives as Fungicides | BAYER CROPSCIENCE AG (DE) | 2013-04-11 | — | — | US | disclosed |
| JP-H10219049-A | PROPYLENE COPOLYMER FILM | NIPPON PORIKEMU KK | 1998-08-18 | — | — | JP | disclosed |
| US-4234561-A | RADIOIMMUNOASSAY, GONADOTROPIN | RESEARCH CORPORATION (US) | 1980-11-18 | — | — | US | disclosed |