⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28155645 | 1.00 | MEN1 (0.37) | — | |
| SCHEMBL17209 | 1.00 | — | — | |
| Water SCHEMBL28056317 | 0.97 | MEN1 (0.35) | — | |
| SCHEMBL28706469 | 0.97 | MEN1 (0.35) | — | |
| Hydrochloric Acid SCHEMBL8977384 | 0.97 | MEN1 (0.35) | — | |
| Ammonia Solution, Strong SCHEMBL9231328 | 0.97 | MEN1 (0.35) | — | |
| Bromide SCHEMBL7773475 | 0.97 | MEN1 (0.35) | — | |
| SCHEMBL15709340 | 0.97 | MEN1 (0.35) | — | |
| Trimethylammonium SCHEMBL27297430 | 0.93 | OPRD1 (0.35) | — | |
| SCHEMBL10612811 | 0.91 | MEN1 (0.32) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0810265-B1 | Substantive stilbene azo dyestuffs | BAYER AG (DE) | 2001-11-21 | — | — | EP | claimed |
| US-5785718-A | DYEING OR PRINTING MATERIALS CONTAINING CELLULOSE AND/OR AMIDE GROUPS | BAYER AKTIENGESELLSCHAFT (DE) | 1998-07-28 | — | — | US | claimed |
| EP-0810265-A1 | Substantive stilbene azo dyestuffs | BAYER AG (DE) | 1997-12-03 | — | — | EP | claimed |
| US-5037964-A | Dyes For Paper And Textiles | SANDOZ LTD. (CH) | 1991-08-06 | — | — | US | claimed |
| EP-0810265-B1 | Substantive stilbene azo dyestuffs | BAYER AG (DE) | 2001-11-21 | — | — | EP | disclosed |
| US-5785718-A | DYEING OR PRINTING MATERIALS CONTAINING CELLULOSE AND/OR AMIDE GROUPS | BAYER AKTIENGESELLSCHAFT (DE) | 1998-07-28 | — | — | US | disclosed |
| EP-0810265-A1 | Substantive stilbene azo dyestuffs | BAYER AG (DE) | 1997-12-03 | — | — | EP | disclosed |
| US-5352334-A | The use of metal-free sulfo group free basic disazo compounds containing two identical 6-hydroxypyrid-2-one coupling component radicals for producing colored paper | SANDOZ LTD. (CH) | 1994-10-04 | — | — | US | disclosed |