⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3400453 | 1.00 | — | — | |
| SCHEMBL5791847 | 1.00 | — | — | |
| SCHEMBL27057 | 0.96 | — | — | |
| SCHEMBL22129606 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL25254922 | 0.92 | — | — | |
| Adamantane SCHEMBL9453810 | 0.92 | CYP2C9 (0.32) | — | |
| Iodide SCHEMBL108198 | 0.92 | — | — | |
| SCHEMBL18239998 | 0.92 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL2783549 | 0.92 | LMNA (0.30) | — | |
| Water SCHEMBL30403964 | 0.92 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010009752-A1 | CURABLE SILICONE COMPOSITIONS COMPRISING CYCLO-ALKYLPHOSPHITES | MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) | 2010-01-28 | — | — | WO | disclosed |