⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23423096 | 0.81 | — | — | |
| SCHEMBL20725835 | 0.74 | — | — | |
| SCHEMBL22965088 | 0.72 | — | — | |
| SCHEMBL21781692 | 0.71 | — | — | |
| SCHEMBL24081307 | 0.71 | — | — | |
| SCHEMBL22183311 | 0.69 | MAPK1 (0.31) | — | |
| SCHEMBL179208 | 0.69 | MAPK1 (0.33) | — | |
| SCHEMBL237181 | 0.67 | MAPK1 (0.40) | — | |
| SCHEMBL941538 | 0.67 | — | — | |
| SCHEMBL12901318 | 0.67 | — | — |
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-3934663-B1 | POLYETHYLENEGLYCOL DERIVATIVES FOR USE IN TREATING CANCER AND/OR INDUCING CASPASE ACTIVITY | DOW GLOBAL TECHNOLOGIES LLC (US) | 2024-06-26 | — | — | EP | disclosed |
| EP-3601392-B1 | NON-IONIC BLOCK COPOLYMERS AND PHARMACEUTICAL COMPOSITIONS DERIVED THEREFROM | ALTUS FORMULATION INC (CA) | 2022-03-09 | — | — | EP | disclosed |