⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20535408 | 0.81 | — | — | |
| SCHEMBL20535235 | 0.81 | — | — | |
| SCHEMBL83296 | 0.81 | EPHX1 (0.34) | — | |
| SCHEMBL4432862 | 0.81 | SIGMAR1 (0.31) | — | |
| SCHEMBL5183836 | 0.79 | EPHX1 (0.37) | — | |
| SCHEMBL21522637 | 0.78 | EPHX1 (0.40) | — | |
| SCHEMBL7102818 | 0.78 | EPHX1 (0.40) | — | |
| SCHEMBL29233372 | 0.78 | EPHX1 (0.40) | — | |
| SCHEMBL20240978 | 0.78 | EPHX1 (0.40) | — | |
| SCHEMBL29233375 | 0.78 | EPHX1 (0.40) | — |
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-20210106944-A1 | ABSORBENT COMPOSITIONS INCLUDING AMINO-SILOXANES | BAKER HUGHES ENERGY SERVICES LLC | 2021-04-15 | — | — | US | disclosed |
| EP-3609604-A1 | ABSORBENT COMPOSITIONS INCLUDING AMINO-SILOXANES | GE Oil & Gas, Inc. (US) | 2020-02-19 | — | — | EP | disclosed |
| WO-2018190815-A1 | ABSORBENT COMPOSITIONS INCLUDING AMINO-SILOXANES | GE Oil & Gas, Inc. (US) | 2018-10-18 | — | — | WO | disclosed |