⚠ 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 | |
|---|---|---|---|---|
| Butane SCHEMBL27993593 | 0.84 | — | — | |
| Propane SCHEMBL28245413 | 0.82 | — | — | |
| Propane SCHEMBL28805123 | 0.82 | — | — | |
| SCHEMBL6820 | 0.82 | — | — | |
| Alcohol SCHEMBL4389824 | 0.80 | — | — | |
| Hexane SCHEMBL29022660 | 0.77 | TSHR (0.54) | — | |
| SCHEMBL4535537 | 0.77 | — | — | |
| SCHEMBL23300848 | 0.76 | — | — | |
| Water SCHEMBL9175584 | 0.76 | — | — | |
| SCHEMBL10400340 | 0.76 | — | — |
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-11807758-B2 | Siloxane polymer and method of producing siloxane polymer | JNC CORPORATION (JP) | 2023-11-07 | — | — | US | disclosed |
| US-20210238419-A1 | SILOXANE POLYMER AND METHOD OF PRODUCING SILOXANE POLYMER | JNC CORPORATION (JP) | 2021-08-05 | — | — | US | disclosed |
| US-6881855-B2 | Norbornyl-substituted silanes and the use thereof | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 2005-04-19 | — | — | US | disclosed |
| US-20030097015-A1 | Norbornyl-substituted silanes and the use thereof | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 2003-05-22 | — | — | US | disclosed |