⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1135902 | 0.78 | TLR4 (0.39) | — | |
| SCHEMBL19860621 | 0.77 | — | — | |
| SCHEMBL11043028 | 0.73 | — | — | |
| SCHEMBL15941432 | 0.73 | — | — | |
| SCHEMBL11042432 | 0.73 | — | — | |
| SCHEMBL11036276 | 0.73 | — | — | |
| SCHEMBL15264311 | 0.72 | — | — | |
| SCHEMBL8948457 | 0.72 | ALDH1A1 (0.38) | — | |
| SCHEMBL13649399 | 0.71 | — | — | |
| SCHEMBL11037969 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10391179-B2 | Organomodified carbosiloxane monomers containing compositions and uses thereof | MOMENTIVE PERFORMANCE MATERIALS INC. (US) | 2019-08-27 | — | — | US | disclosed |
| US-9944742-B2 | Organo-modified silicone polymers | MOMENTIVE PERFORMANCE MATERIALS INC. (US) | 2018-04-17 | — | — | US | disclosed |