⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4475444 | 0.73 | FFAR3 (0.32) | — | |
| SCHEMBL16573470 | 0.68 | ALDH1A1 (0.32) | — | |
| SCHEMBL28099391 | 0.62 | MEN1 (0.43) | — | |
| SCHEMBL1784541 | 0.61 | FFAR3 (0.38) | — | |
| SCHEMBL2448745 | 0.61 | FFAR3 (0.38) | — | |
| SCHEMBL375735 | 0.61 | FFAR3 (0.38) | — | |
| SCHEMBL1031267 | 0.61 | FFAR3 (0.38) | — | |
| SCHEMBL8187643 | 0.61 | ALDH1A1 (0.36) | — | |
| SCHEMBL29011393 | 0.61 | FDPS (0.37) | — | |
| SCHEMBL29084204 | 0.61 | FFAR3 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111615405-A | Polymeric prodrugs and subcutaneous and/or intramuscular administration thereof | 国家科学研究中心 | 2020-09-01 | — | — | CN | disclosed |