⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3938232 | 0.78 | — | — | |
| SCHEMBL5784399 | 0.75 | NPSR1 (0.44) | — | |
| SCHEMBL10523584 | 0.75 | — | — | |
| SCHEMBL1570545 | 0.75 | PTGS1 (0.32) | — | |
| SCHEMBL528608 | 0.75 | PTGS1 (0.32) | — | |
| SCHEMBL6131644 | 0.75 | — | — | |
| SCHEMBL1679962 | 0.74 | — | — | |
| SCHEMBL5478658 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL22583552 | 0.72 | HCAR2 (0.40) | — | |
| SCHEMBL1478785 | 0.71 | — | — |
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-115028872-A | Protein adsorption resistant hydrogel material and preparation method and application thereof | 金陵科技学院 | 2022-09-09 | — | — | CN | claimed |
| CN-115066457-A | Crosslinkable polysiloxanes | 联邦科学和工业研究组织 | 2022-09-16 | — | — | CN | disclosed |
| CN-108473630-B | Curable polymeric materials and methods of use thereof | 3M创新有限公司 | 2020-09-18 | — | — | CN | disclosed |