⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29813426 | 0.96 | — | — | |
| SCHEMBL18510296 | 0.91 | MEN1 (0.32) | — | |
| SCHEMBL29813495 | 0.85 | DNM1 (0.31) | — | |
| SCHEMBL14700556 | 0.82 | TSHR (0.33) | — | |
| SCHEMBL12937852 | 0.80 | MEN1 (0.38) | — | |
| SCHEMBL19728322 | 0.80 | MEN1 (0.38) | — | |
| SCHEMBL13944422 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL3627362 | 0.79 | — | — | |
| SCHEMBL15248754 | 0.79 | — | — | |
| SCHEMBL14217008 | 0.79 | — | — |
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-3606643-B1 | ABSORBENT COMPOSITIONS INCLUDING AMINO-SILOXANES | GE OIL & GAS INC (US) | 2023-08-30 | — | — | EP | disclosed |
| US-20200108343-A1 | ABSORBENT COMPOSITIONS INCLUDING AMINO-SILOXANES | BAKER HUGHES ENERGY SERVICES LLC | 2020-04-09 | — | — | US | disclosed |