⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4288459 | 0.82 | — | — | |
| SCHEMBL2671031 | 0.77 | CAMK2A (0.50) | — | |
| SCHEMBL10682086 | 0.76 | LMNA (0.58) | — | |
| SCHEMBL51015 | 0.76 | — | — | |
| SCHEMBL5956653 | 0.76 | TSHR (0.58) | — | |
| SCHEMBL11170976 | 0.76 | — | — | |
| SCHEMBL517057 | 0.76 | — | — | |
| SCHEMBL19748644 | 0.76 | — | — | |
| SCHEMBL5384975 | 0.74 | — | — | |
| SCHEMBL17228573 | 0.74 | CAMK2A (0.48) | — |
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-109258776-A | A kind of mussel phosphate-free water-retaining agent and preparation method thereof based on chitosan derivatives | 浙江省海洋水产研究所 | 2019-01-25 | — | — | CN | disclosed |
| US-20090137499-A1 | BENZYLPHENYL GLUCOPYRANOSIDE DERIVATIVE | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2009-05-28 | — | — | US | disclosed |
| EP-2048150-A1 | BENZYL PHENYL GLUCOPYRANOSIDE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2009-04-15 | — | — | EP | disclosed |