⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9342 | 0.96 | — | — | |
| SCHEMBL6989643 | 0.93 | — | — | |
| SCHEMBL20141352 | 0.93 | — | — | |
| SCHEMBL664039 | 0.74 | — | — | |
| SCHEMBL293898 | 0.69 | — | — | |
| SCHEMBL1498735 | 0.69 | — | — | |
| SCHEMBL1031834 | 0.69 | — | — | |
| SCHEMBL41539 | 0.69 | — | — | |
| SCHEMBL11372052 | 0.69 | — | — | |
| SCHEMBL16872607 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3538588-A1 | Polycarbonate Based Polyols | Dow Global Technologies LLC (US) | 2019-09-18 | — | — | EP | disclosed |
| WO-2018089566-A1 | Polycarbonate Based Polyols | DOW GLOBAL TECHNOLOGIES LLC (US) | 2018-05-17 | — | — | WO | disclosed |