⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21882131 | 0.78 | — | — | |
| SCHEMBL49454 | 0.75 | — | — | |
| SCHEMBL21882093 | 0.69 | — | — | |
| SCHEMBL22703508 | 0.67 | — | — | |
| SCHEMBL21882127 | 0.67 | — | — | |
| SCHEMBL31722297 | 0.65 | TSHR (0.30) | — | |
| SCHEMBL27966736 | 0.65 | — | — | |
| SCHEMBL15606106 | 0.63 | — | — | |
| SCHEMBL12414925 | 0.63 | — | — | |
| SCHEMBL17053481 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230279031-A1 | N-ALKYL SUBSTITUTED CYCLIC AND OLIGOMERIC PERHYDRIDOSILAZANES, METHODS OF PREPARATION THEREOF, AND SILICON NITRIDE FILMS FORMED THEREFROM | GELEST, INC. | 2023-09-07 | — | — | US | disclosed |