⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17799141 | 0.71 | — | — | |
| SCHEMBL30105433 | 0.69 | — | — | |
| SCHEMBL4848745 | 0.66 | — | — | |
| SCHEMBL4852467 | 0.62 | — | — | |
| SCHEMBL4845215 | 0.62 | — | — | |
| SCHEMBL17273342 | 0.62 | — | — | |
| SCHEMBL31296681 | 0.62 | — | — | |
| SCHEMBL28751360 | 0.61 | — | — | |
| SCHEMBL18837514 | 0.60 | — | — | |
| SCHEMBL4844443 | 0.59 | CYP1A2 (0.38) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9876182-B2 | Thieno-containing compounds and processes and uses thereof | UNIVERSITY OF OREGON (US) | 2018-01-23 | — | — | US | disclosed |
| US-20160164011-A1 | THIENO-CONTAINING COMPOUNDS AND PROCESSES AND USES THEREOF | UNIVERSITY OF OREGON (US) | 2016-06-09 | — | — | US | disclosed |
| WO-2015013656-A2 | THIENO-CONTAINING COMPOUNDS AND PROCESSES AND USES THEREOF | UNIVERSITY OF OREGON (US) | 2015-01-29 | — | — | WO | disclosed |