⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19257464 | 0.83 | TSHR (0.41) | — | |
| SCHEMBL27782220 | 0.83 | TSHR (0.41) | — | |
| SCHEMBL28048802 | 0.78 | — | — | |
| SCHEMBL20889082 | 0.78 | — | — | |
| SCHEMBL997152 | 0.78 | — | — | |
| SCHEMBL23539861 | 0.78 | — | — | |
| SCHEMBL23540957 | 0.78 | — | — | |
| SCHEMBL9325432 | 0.78 | LMNA (0.30) | — | |
| SCHEMBL31368881 | 0.78 | — | — | |
| SCHEMBL360480 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010033218-A1 | POLYMER CONJUGATES OF OSTEOCALCIN PEPTIDES | NEKTAR THERAPEUTICS (US) | 2010-03-25 | — | — | WO | disclosed |