⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL753451 | 0.71 | — | — | |
| SCHEMBL3369094 | 0.71 | — | — | |
| SCHEMBL6859964 | 0.71 | — | — | |
| SCHEMBL20776329 | 0.71 | — | — | |
| SCHEMBL13424690 | 0.71 | — | — | |
| SCHEMBL2542172 | 0.71 | — | — | |
| SCHEMBL2454984 | 0.71 | — | — | |
| SCHEMBL4178398 | 0.67 | — | — | |
| SCHEMBL4178399 | 0.67 | — | — | |
| SCHEMBL2156203 | 0.67 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5023325-A | Colorfastness, photostability | CIBA-GEIGY CORPORATION (US) | 1991-06-11 | — | — | US | disclosed |
| US-5003052-A | Monoazo fiber reactive dye for cellulose, polyamides, wool, silk, polyurethanes and leather | CIBA-GEIGY CORPORATION (US) | 1991-03-26 | — | — | US | disclosed |
| EP-0208655-B1 | REACTIVE DYES, THEIR PREPARATION AND THEIR USE | CIBA-GEIGY AG (CH) | 1990-08-16 | — | — | EP | disclosed |
| EP-0210951-B1 | REACTIVE DYES, THEIR PREPARATION AND THEIR USE | CIBA-GEIGY AG (CH) | 1990-03-07 | — | — | EP | disclosed |
| EP-0210951-A1 | Reactive dyes, their preparation and their use | CIBA-GEIGY AG (CH) | 1987-02-04 | — | — | EP | disclosed |
| EP-0208655-A2 | Reactive dyes, their preparation and their use | CIBA-GEIGY AG (CH) | 1987-01-14 | — | — | EP | disclosed |