⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24177400 | 0.80 | — | — | |
| SCHEMBL6725179 | 0.72 | — | — | |
| SCHEMBL14616065 | 0.71 | — | — | |
| SCHEMBL6722295 | 0.68 | — | — | |
| SCHEMBL21518307 | 0.67 | ALDH1A1 (0.37) | — | |
| SCHEMBL21518289 | 0.67 | ALDH1A1 (0.37) | — | |
| SCHEMBL21518284 | 0.67 | ALDH1A1 (0.37) | — | |
| SCHEMBL4406961 | 0.65 | — | — | |
| SCHEMBL2183252 | 0.63 | — | — | |
| SCHEMBL18197743 | 0.63 | ALDH1A1 (0.35) | — |
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-20230167238-A1 | POLYMETRIC BIOMATERIALS DERIVED FROM PHENOLIC MONOMERS AND THEIR MEDICAL USES | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2023-06-01 | — | — | US | disclosed |
| US-20200181321-A1 | POLYMERIC BIOMATERIALS DERIVED FROM PHENOLIC MONOMERS AND THEIR MEDICAL USES | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY | 2020-06-11 | — | — | US | disclosed |