⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18480131 | 0.72 | — | — | |
| SCHEMBL22808124 | 0.72 | — | — | |
| SCHEMBL3851447 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL14094789 | 0.72 | — | — | |
| Ethane SCHEMBL27456190 | 0.69 | — | — | |
| Chloromethane SCHEMBL27722511 | 0.69 | — | — | |
| Chloromethane SCHEMBL28011683 | 0.69 | — | — | |
| Propane SCHEMBL27332347 | 0.67 | TSHR (0.30) | — | |
| SCHEMBL23065596 | 0.67 | — | — | |
| SCHEMBL22909208 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230257402-A1 | FUNCTIONALIZED FLUOROALKYL SILANE, AND SYNTHETIC METHOD THEREFOR AND APPLICATION THEREOF | EAST CHINA NORMAL UNIVERSITY (CN) | 2023-08-17 | — | — | US | disclosed |
| WO-2019237582-A1 | COMPLEX OF SILICA AND ETHYLENE PROPYLENE RUBBER AND PREPARATION METHOD THEREFOR | 大连理工大学 | 2019-12-19 | — | — | WO | disclosed |
| US-10450331-B2 | Functionalized cyanosilane and synthesis method and use thereof | EAST CHINA NORMAL UNIVERSITY (CN) | 2019-10-22 | — | — | US | disclosed |
| US-20180141964-A1 | FUNCTIONALIZED CYANOSILANE AND SYNTHESIS METHOD AND USE THEREOF | EAST CHINA NORMAL UNIVERSITY (CN) | 2018-05-24 | — | — | US | disclosed |