⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27540732 | 0.64 | — | — | |
| SCHEMBL8309865 | 0.56 | — | — | |
| SCHEMBL6568846 | 0.55 | — | — | |
| SCHEMBL7537133 | 0.55 | — | — | |
| SCHEMBL9041918 | 0.55 | — | — | |
| SCHEMBL7541201 | 0.54 | — | — | |
| SCHEMBL460074 | 0.50 | — | — | |
| SCHEMBL21256988 | 0.48 | — | — | |
| SCHEMBL5421537 | 0.48 | — | — | |
| SCHEMBL3071846 | 0.48 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10053484-B2 | Heterocycle-substituted xanthene dyes | BIOTIUM, INC. (US) | 2018-08-21 | — | — | US | disclosed |
| US-20170247402-A1 | HETEROCYCLE-SUBSTITUTED XANTHENE DYES | BIOTIUM, INC. | 2017-08-31 | — | — | US | disclosed |
| US-9579402-B2 | Heterocycle-substituted xanthene dyes | BIOTIUM, INC. (US) | 2017-02-28 | — | — | US | disclosed |
| EP-2507220-B1 | HETEROCYCLE-SUBSTITUTED XANTHENE DYES | BIOTIUM INC (US) | 2016-10-05 | — | — | EP | disclosed |
| EP-2507220-A1 | HETEROCYCLE-SUBSTITUTED XANTHENE DYES | Biotium Inc. (US) | 2012-10-10 | — | — | EP | disclosed |
| WO-2011068569-A1 | HETEROCYCLE-SUBSTITUTED XANTHENE DYES | BIOTIUM, INC. (US) | 2011-06-09 | — | — | WO | disclosed |
| US-20110136201-A1 | HETEROCYCLE-SUBSTITUTED XANTHENE DYES | BIOTIUM, INC. (US) | 2011-06-09 | — | — | US | disclosed |