⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31379442 | 0.83 | — | — | |
| SCHEMBL3945045 | 0.75 | TSHR (0.35) | — | |
| SCHEMBL8009240 | 0.75 | TSHR (0.35) | — | |
| SCHEMBL76817 | 0.75 | TSHR (0.35) | — | |
| SCHEMBL6245461 | 0.75 | TSHR (0.35) | — | |
| SCHEMBL8532452 | 0.75 | — | — | |
| SCHEMBL6826633 | 0.75 | — | — | |
| SCHEMBL387656 | 0.73 | — | — | |
| SCHEMBL19721528 | 0.73 | — | — | |
| SCHEMBL9132693 | 0.73 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114716610-B | Thermosetting material capable of being chemically degraded and recycled and preparation method thereof | 中国科学技术大学 | 2023-06-16 | — | — | CN | disclosed |
| US-7923522-B2 | excellent in stability of particle size and to be used for electronic materials; adding a hydrolyzable silane compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2011-04-12 | — | — | US | disclosed |
| US-20080248280-A1 | Process for Preparing a Dispersion Liquid of Zeolite Fine Particles | SHIN-ETSU CHEMICAL CO., LTD. | 2008-10-09 | — | — | US | disclosed |