⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8595598 | 0.81 | — | — | |
| SCHEMBL3918740 | 0.79 | — | — | |
| Lithium SCHEMBL31125796 | 0.79 | — | — | |
| SCHEMBL23322283 | 0.71 | — | — | |
| SCHEMBL22043806 | 0.71 | — | — | |
| SCHEMBL23140264 | 0.69 | — | — | |
| SCHEMBL9507075 | 0.69 | — | — | |
| SCHEMBL23601612 | 0.67 | CYP1A2 (0.39) | — | |
| SCHEMBL24689973 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL31561439 | 0.65 | UBE2N (0.55) | — |
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-2072465-B1 | Use of a metallic organosilicate polymer for the protection of compounds that are sensitive to oxidation and/or electromagnetic radiation | COMMISSARIAT L ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2015-05-13 | — | — | EP | disclosed |
| EP-2072465-A2 | Use of a metallic organosilicate polymer for the protection of compounds that are sensitive to oxidation and/or electromagnetic radiation | Commissariat à l'Energie Atomique (FR) | 2009-06-24 | — | — | EP | disclosed |
| WO-2007047315-A1 | AMIFOSTINE DIHYDRATE CRYSTALLINE COMPOSITION | ALBEMARLE CORPORATION (US) | 2007-04-26 | — | — | WO | disclosed |