⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11718607 | 0.77 | — | — | |
| SCHEMBL27465999 | 0.76 | — | — | |
| SCHEMBL1969594 | 0.74 | — | — | |
| SCHEMBL17644243 | 0.74 | TSHR (0.40) | — | |
| SCHEMBL24924926 | 0.71 | TSHR (0.30) | — | |
| SCHEMBL17607721 | 0.70 | — | — | |
| SCHEMBL7760956 | 0.70 | — | — | |
| SCHEMBL5618876 | 0.69 | TSHR (0.33) | — | |
| SCHEMBL2801431 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL598372 | 0.69 | TSHR (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4208492-A1 | CROSS-LINKABLE SUBSTANCES BASED ON ORGANYLOXYSILANE-TERMINATED POLYMERS | Wacker Chemie AG (DE) | 2023-07-12 | — | — | EP | disclosed |
| US-20080241529-A1 | Flameproofed adhesive and sealing materials | CLARIANT INTERNATIONAL LTD. | 2008-10-02 | — | — | US | disclosed |
| EP-1975217-A2 | Flame-retardant adhesive and sealing substances | Clariant International Ltd. (CH) | 2008-10-01 | — | — | EP | disclosed |