⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2478526 | 0.88 | — | — | |
| SCHEMBL1109684 | 0.88 | — | — | |
| SCHEMBL10661516 | 0.83 | — | — | |
| SCHEMBL10658980 | 0.81 | — | — | |
| SCHEMBL10664747 | 0.76 | — | — | |
| SCHEMBL9849570 | 0.75 | HSD17B10 (0.30) | — | |
| SCHEMBL524562 | 0.74 | — | — | |
| SCHEMBL4635333 | 0.74 | — | — | |
| SCHEMBL7866733 | 0.74 | TSHR (0.36) | — | |
| SCHEMBL7792946 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6307081-B1 | MACROMONOMER HAS ONE OR MORE SILICON-BONDED HYDROGEN ATOMS AT ONE MOLECULAR CHAIN TERMINAL, AND ONE OR MORE ALIPHATICALLY UNSATURATED SILICON-BONDED ORGANIC GROUPS AT THE OTHER MOLECULAR CHAIN TERMINAL. | DOW CORNING SILICONE COMPANY, LTD. (JP) | 2001-10-23 | — | — | US | disclosed |