⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24586939 | 0.75 | — | — | |
| SCHEMBL3467580 | 0.70 | — | — | |
| SCHEMBL10084677 | 0.65 | — | — | |
| Iodide SCHEMBL4427932 | 0.65 | — | — | |
| SCHEMBL30782700 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL7679874 | 0.64 | — | — | |
| SCHEMBL14529839 | 0.62 | — | — | |
| SCHEMBL19558005 | 0.62 | — | — | |
| SCHEMBL10597085 | 0.61 | — | — | |
| SCHEMBL23696880 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4399091-A | Comfort additive for acrylic fibers | BASF WYANDOTTE CORPORATION (US) | 1983-08-16 | — | — | US | disclosed |
| US-3940376-A | Permanently antistatic shaped structures of acrylonitrile polymers | BAYER AKTIENGESELLSCHAFT (DT) | 1976-02-24 | — | — | US | disclosed |