⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6524302 | 0.91 | CA12 (0.31) | — | |
| SCHEMBL6520565 | 0.87 | TSHR (0.39) | — | |
| SCHEMBL14282330 | 0.85 | TSHR (0.35) | — | |
| SCHEMBL6513678 | 0.84 | TSHR (0.47) | — | |
| SCHEMBL6517087 | 0.83 | MAPK1 (0.31) | — | |
| SCHEMBL6514852 | 0.82 | TSHR (0.33) | — | |
| SCHEMBL6518797 | 0.80 | MGAM (0.38) | — | |
| SCHEMBL6515864 | 0.79 | THRB (0.46) | — | |
| SCHEMBL6514764 | 0.79 | MAPT (0.36) | — | |
| SCHEMBL6517115 | 0.78 | TSHR (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6958366-B2 | Antifouling coating composition and novel resin | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2005-10-25 | — | — | US | disclosed |
| US-20030118544-A1 | Antifouling coating composition and novel resin | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2003-06-26 | — | — | US | disclosed |