⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28949447 | 0.80 | — | — | |
| SCHEMBL8664479 | 0.74 | LMNA (0.35) | — | |
| SCHEMBL28134068 | 0.72 | TSHR (0.35) | — | |
| SCHEMBL17656831 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL5981771 | 0.69 | TP53 (0.43) | — | |
| SCHEMBL4317415 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL4351053 | 0.67 | LMNA (0.36) | — | |
| SCHEMBL10975192 | 0.67 | LMNA (0.36) | — | |
| SCHEMBL4351050 | 0.67 | LMNA (0.36) | — | |
| SCHEMBL542271 | 0.65 | KDM4E (0.33) | — |
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-0006438-B1 | HYDROXYL GROUPS-CONTAINING COPOLYMERS OF VINYL ESTER AND VINYL HALIDE; THEIR PREPARATION AND USE | Consortium für elektrochemische Industrie GmbH (DE) | 1983-10-05 | — | — | EP | disclosed |
| EP-0006438-A1 | Hydroxyl groups-containing copolymers of vinyl ester and vinyl halide; their preparation and use | Consortium für elektrochemische Industrie GmbH (DE) | 1980-01-09 | — | — | EP | disclosed |