⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14883986 | 0.75 | BTK (0.31) | — | |
| SCHEMBL24465304 | 0.74 | TP53 (0.32) | — | |
| SCHEMBL14883988 | 0.74 | BTK (0.37) | — | |
| SCHEMBL3435204 | 0.73 | EPHX1 (0.43) | — | |
| SCHEMBL22503049 | 0.73 | HDAC8 (0.39) | — | |
| SCHEMBL14883987 | 0.73 | BTK (0.31) | — | |
| SCHEMBL10064142 | 0.73 | PGR (0.37) | — | |
| SCHEMBL3435835 | 0.71 | RAB9A (0.36) | — | |
| SCHEMBL13201521 | 0.71 | CNR2 (0.36) | — | |
| SCHEMBL18198986 | 0.71 | CHRM2 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11839700-B2 | Bio-electrode composition, bio-electrode, and method for manufacturing a bio-electrode | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-12-12 | — | — | US | disclosed |
| US-11839700-B2 | Bio-electrode composition, bio-electrode, and method for manufacturing a bio-electrode | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-12-12 | — | — | US | disclosed |
| US-10695554-B2 | Bio-electrode composition, bio-electrode, method for manufacturing the bio-electrode, and polymer | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2020-06-30 | — | — | US | disclosed |