⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9817087 | 0.67 | TSHR (0.34) | — | |
| SCHEMBL9817124 | 0.67 | TSHR (0.34) | — | |
| SCHEMBL17070883 | 0.63 | MEN1 (0.38) | — | |
| SCHEMBL25921552 | 0.63 | MEN1 (0.38) | — | |
| SCHEMBL10866200 | 0.62 | CA2 (0.34) | — | |
| SCHEMBL2822049 | 0.62 | CA2 (0.34) | — | |
| SCHEMBL20201549 | 0.62 | CA2 (0.34) | — | |
| SCHEMBL10409636 | 0.62 | CA2 (0.34) | — | |
| SCHEMBL8928363 | 0.62 | — | — | |
| SCHEMBL25220010 | 0.62 | CA2 (0.37) | — |
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-0709392-B1 | Process for the preparation of 3-halogeno- or -pseudohalogeno-alkylsilane esters, respectively | DEGUSSA (DE) | 2001-05-16 | — | — | EP | disclosed |
| US-5616762-A | Process for the preparation of 3-halo-and pseudohalo-alkylsilane esters | HUELS AKTIENGESELLSCHAFT (DE) | 1997-04-01 | — | — | US | disclosed |
| EP-0709392-A1 | Process for the preparation of 3-halogeno- or -pseudohalogeno-alkylsilane esters, respectively | HÜLS AKTIENGESELLSCHAFT (DE) | 1996-05-01 | — | — | EP | disclosed |