⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9116470 | 0.87 | TRPV4 (0.32) | — | |
| SCHEMBL149649 | 0.85 | TRPV4 (0.33) | — | |
| SCHEMBL8633267 | 0.81 | — | — | |
| SCHEMBL6591105 | 0.80 | — | — | |
| SCHEMBL9117642 | 0.77 | MEN1 (0.32) | — | |
| SCHEMBL17835439 | 0.75 | TRPV4 (0.31) | — | |
| SCHEMBL2316921 | 0.70 | TRPV4 (0.31) | — | |
| SCHEMBL57543 | 0.69 | TRPV4 (0.41) | — | |
| SCHEMBL9625848 | 0.69 | TRPV4 (0.41) | — | |
| SCHEMBL17023417 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995021893-A1 | AZO DYES | ZENECA LIMITED (GB) | 1995-08-17 | — | — | WO | disclosed |
| EP-0356014-B1 | Reactive Dyes | ZENECA LTD (GB) | 1994-11-30 | — | — | EP | disclosed |
| US-5189162-A | Colorfast bright dyes for cellulose materials | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-02-23 | — | — | US | disclosed |
| US-5171852-A | Dye cellulose textiles bright reddish blue shades | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-12-15 | — | — | US | disclosed |
| US-5126450-A | Reactive dyes; blue shades on cotton | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-06-30 | — | — | US | disclosed |
| EP-0279122-B1 | REACTIVE DYES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-06-10 | — | — | EP | disclosed |
| EP-0437920-A1 | Reactive dyes | ZENECA LIMITED (GB) | 1991-07-24 | — | — | EP | disclosed |
| EP-0432879-A1 | Reactive dyes | ZENECA LIMITED (GB) | 1991-06-19 | — | — | EP | disclosed |
| US-5019134-A | Triphenodioxazines | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-05-28 | — | — | US | disclosed |
| EP-0356014-A1 | Reactive Dyes | ZENECA LIMITED (GB) | 1990-02-28 | — | — | EP | disclosed |
| EP-0279122-A2 | Reactive dyes | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-08-24 | — | — | EP | disclosed |