⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16115702 | 0.72 | TSHR (0.33) | — | |
| SCHEMBL7081983 | 0.62 | — | — | |
| SCHEMBL28227116 | 0.61 | — | — | |
| SCHEMBL14648918 | 0.61 | TSHR (0.37) | — | |
| SCHEMBL28101799 | 0.61 | TSHR (0.37) | — | |
| SCHEMBL7024903 | 0.60 | — | — | |
| SCHEMBL156544 | 0.60 | POLB (0.36) | — | |
| SCHEMBL11579330 | 0.60 | POLB (0.36) | — | |
| SCHEMBL15905284 | 0.59 | — | — | |
| SCHEMBL4959416 | 0.58 | TSHR (0.31) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1694750-B1 | PROCESS FOR CALENDERING OF POLYESTERS | EASTMAN CHEM CO (US) | 2009-08-19 | — | — | EP | claimed |