⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1580157 | 0.69 | — | — | |
| SCHEMBL902747 | 0.62 | TSHR (0.33) | — | |
| SCHEMBL1512787 | 0.61 | — | — | |
| SCHEMBL6400625 | 0.60 | — | — | |
| SCHEMBL168340 | 0.60 | — | — | |
| SCHEMBL1688001 | 0.60 | — | — | |
| SCHEMBL6126581 | 0.58 | — | — | |
| SCHEMBL3804881 | 0.58 | — | — | |
| SCHEMBL8675160 | 0.58 | — | — | |
| SCHEMBL1460960 | 0.57 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6403581-B1 | ANTITUMOR | AMERICAN CYANAMID COMPANY | 2002-06-11 | — | — | US | claimed |
| US-20180256543-A1 | SUBSTITUTED 5-HYDROXYOXINDOLES AND THEIR USE AS ANALGESICS AND FEVER REDUCERS | CARAFE DRUG INNOVATION, LLC. | 2018-09-13 | — | — | US | disclosed |
| WO-2016179157-A1 | SUBSTITUTED 5-HYDROXYOXINDOLES AND THEIR USE AS ANALGESICS AND FEVER REDUCERS | CARAFE DRUG INNOVATION, LLC (US) | 2016-11-10 | — | — | WO | disclosed |
| US-6403581-B1 | ANTITUMOR | AMERICAN CYANAMID COMPANY | 2002-06-11 | — | — | US | disclosed |