⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28673871 | 0.71 | — | — | |
| SCHEMBL3698202 | 0.67 | — | — | |
| SCHEMBL27591381 | 0.67 | — | — | |
| SCHEMBL29201545 | 0.65 | — | — | |
| SCHEMBL2182653 | 0.65 | — | — | |
| SCHEMBL29201635 | 0.65 | — | — | |
| SCHEMBL2992580 | 0.65 | — | — | |
| SCHEMBL978492 | 0.64 | — | — | |
| SCHEMBL8839124 | 0.61 | TSHR (0.33) | — | |
| SCHEMBL6708461 | 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 |
|---|---|---|---|---|---|---|---|
| CN-105452261-A | Continuous process for the preparation of thiocarboxylate silane | MOMENTIVE PERFORMANCE MAT INC | 2016-03-30 | — | — | CN | disclosed |