⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8995946 | 0.80 | — | — | |
| SCHEMBL11684311 | 0.76 | MAPT (0.44) | — | |
| SCHEMBL274676 | 0.71 | — | — | |
| SCHEMBL40704 | 0.69 | — | — | |
| SCHEMBL5494561 | 0.69 | TRPA1 (0.61) | — | |
| O-Xylene SCHEMBL29287109 | 0.69 | TSHR (0.83) | — | |
| SCHEMBL4021982 | 0.69 | ACHE (0.57) | — | |
| Hydrochloric Acid SCHEMBL11803918 | 0.69 | TRPA1 (0.46) | — | |
| SCHEMBL67969 | 0.69 | — | — | |
| O-Xylene SCHEMBL170581 | 0.68 | TSHR (1.00) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114920768-A | Preparation method and application of tert-butyl substituted dihydrosilane and chiral silane | 深圳湾实验室 | 2022-08-19 | — | — | CN | claimed |
| CN-114920768-A | Preparation method and application of tert-butyl substituted dihydrosilane and chiral silane | 深圳湾实验室 | 2022-08-19 | — | — | CN | disclosed |
| US-8153836-B2 | Silsesquioxane compound mixture, hydrolyzable silane compound, making methods, resist composition, patterning process, and substrate processing | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2012-04-10 | — | — | US | disclosed |
| US-20080311514-A1 | SILSESQUIOXANE COMPOUND MIXTURE, HYDROLYZABLE SILANE COMPOUND, MAKING METHODS, RESIST COMPOSITION, PATTERNING PROCESS, AND SUBSTRATE PROCESSING | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2008-12-18 | — | — | US | disclosed |