⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9760131 | 0.81 | TSHR (0.34) | — | |
| SCHEMBL9340405 | 0.74 | TSHR (0.31) | — | |
| SCHEMBL9574897 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL237171 | 0.71 | TSHR (0.39) | — | |
| SCHEMBL8988187 | 0.70 | TSHR (0.38) | — | |
| SCHEMBL28059039 | 0.70 | TSHR (0.38) | — | |
| SCHEMBL9336598 | 0.69 | TSHR (0.42) | — | |
| SCHEMBL9747219 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL1507509 | 0.69 | TSHR (0.40) | — | |
| SCHEMBL2232657 | 0.67 | TSHR (0.40) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0283824-A2 | Polysaccharide graft polymers containing acetal groups and their conversion to aldehyde groups | National Starch and Chemical Investment Holding Corporation (US) | 1988-09-28 | — | — | EP | claimed |
| US-5049634-A | Derivatized and/or crosslinked products from acetal- and aldehyde-containing polysaccharide graft polymers | NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) | 1991-09-17 | — | — | US | disclosed |