⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21653358 | 0.81 | GRM2 (0.39) | — | |
| SCHEMBL31332966 | 0.73 | KDM4E (0.33) | — | |
| SCHEMBL31376015 | 0.72 | PTGER4 (0.36) | — | |
| SCHEMBL29955121 | 0.72 | PTGER4 (0.33) | — | |
| SCHEMBL13311382 | 0.66 | NOTUM (0.50) | — | |
| SCHEMBL14473516 | 0.66 | ADRA2A (0.49) | — | |
| SCHEMBL3203984 | 0.65 | ALDH1A1 (0.44) | — | |
| SCHEMBL12319888 | 0.65 | — | — | |
| SCHEMBL5833155 | 0.65 | — | — | |
| SCHEMBL17066933 | 0.63 | JAK2 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3087155-A1 | CONTROL OF SUSTAINED CASING PRESSURE IN WELLBORE ANNULI | Albemarle Corporation (US) | 2016-11-02 | — | — | EP | disclosed |
| US-20160289527-A1 | CONTROL OF SUSTAINED CASING PRESSURE IN WELLBORE ANNULI | ALBEMARLE CORP (US) | 2016-10-06 | — | — | US | disclosed |
| WO-2015100004-A1 | CONTROL OF SUSTAINED CASING PRESSURE IN WELLBORE ANNULI | ALBEMARLE CORPORATION (US) | 2015-07-02 | — | — | WO | disclosed |