⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL332928 | 0.76 | — | — | |
| SCHEMBL11431878 | 0.73 | — | — | |
| SCHEMBL5408346 | 0.73 | — | — | |
| SCHEMBL653461 | 0.70 | SLC6A3 (0.36) | — | |
| SCHEMBL5398625 | 0.70 | SPHK1 (0.30) | — | |
| SCHEMBL9186090 | 0.67 | — | — | |
| SCHEMBL8653195 | 0.64 | — | — | |
| SCHEMBL8506983 | 0.62 | — | — | |
| SCHEMBL21086749 | 0.62 | — | — | |
| SCHEMBL11317051 | 0.62 | — | — |
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-0031505-A1 | Monoazo dyestuffs of the amino-pyridine series, their preparation and use in dyeing thermoplastic synthetics in the mass, as well as dyestuff compositions | BASF Aktiengesellschaft (DE) | 1981-07-08 | — | — | EP | disclosed |
| US-4210583-A | FAST DYEINGS ON POLYESTERS AND THEIR BLENDS WITH COTTON | BASF AKTIENGESELLSCHAFT (DE) | 1980-07-01 | — | — | US | disclosed |