⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11743501 | 0.74 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL9568850 | 0.73 | — | — | |
| SCHEMBL5826093 | 0.61 | — | — | |
| SCHEMBL2816040 | 0.57 | — | — | |
| SCHEMBL16911054 | 0.57 | — | — | |
| SCHEMBL17176854 | 0.57 | — | — | |
| SCHEMBL7355095 | 0.56 | — | — | |
| SCHEMBL10814241 | 0.56 | — | — | |
| SCHEMBL1766308 | 0.55 | — | — | |
| SCHEMBL1766781 | 0.55 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5686393-A | Arthropodicidal oxazolines and thiazolines | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-11-11 | — | — | US | disclosed |