⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16455 | 0.78 | LMNA (0.41) | — | |
| SCHEMBL1526181 | 0.75 | CA12 (0.35) | — | |
| Hydrochloric Acid SCHEMBL28869556 | 0.73 | TSHR (0.37) | — | |
| Guanidine SCHEMBL28078381 | 0.71 | TSHR (0.35) | — | |
| SCHEMBL11648272 | 0.69 | TSHR (0.33) | — | |
| SCHEMBL28227742 | 0.67 | MEN1 (0.32) | — | |
| Fluoride SCHEMBL28130568 | 0.67 | CRBN (0.38) | — | |
| SCHEMBL2053410 | 0.66 | — | — | |
| Biguanide SCHEMBL28138888 | 0.65 | MEN1 (0.31) | — | |
| SCHEMBL6013580 | 0.64 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110040057-A1 | LIGAND-COUPLED INITIATOR POLYMERS AND METHODS OF USE | Surmodics Coatings, LLC | 2011-02-17 | — | — | US | disclosed |
| US-7820158-B2 | Ligand-coupled initiator polymers and methods of use | SURMODICS, INC. (US) | 2010-10-26 | — | — | US | disclosed |
| EP-1613749-B1 | LIGAND-COUPLED INITIATOR POLYMERS AND METHODS OF USE | SURMODICS INC (US) | 2010-07-07 | — | — | EP | disclosed |
| US-20040203075-A1 | Ligand-coupled initiator polymers and methods of use | SURMODICS, INC. | 2004-10-14 | — | — | US | disclosed |