⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL208812 | 0.86 | TSHR (0.61) | — | |
| SCHEMBL11578213 | 0.84 | TSHR (0.64) | — | |
| SCHEMBL779445 | 0.78 | SMN1; SMN2 (0.76) | — | |
| SCHEMBL4124349 | 0.75 | — | — | |
| SCHEMBL15443199 | 0.74 | — | — | |
| SCHEMBL3131966 | 0.74 | MEN1 (0.58) | — | |
| SCHEMBL11554126 | 0.74 | TSHR (0.52) | — | |
| SCHEMBL11553321 | 0.74 | TSHR (0.52) | — | |
| SCHEMBL20617537 | 0.73 | L3MBTL1 (0.53) | — | |
| SCHEMBL8603867 | 0.73 | — | — |
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-11773055-B2 | Chemical derivatives and methods for synthesizing and compounding chemical derivatives related to capsaicin palmitate and capsaicin prodrugs | CHORDA PHARMA, INC. (US) | 2023-10-03 | — | — | US | disclosed |
| CN-1306525-A | Carboxylic acids or isosteres thereof of heterocyclic compounds containing multiple hetero atoms | GPI NIL HOLDING INC (US) | 2001-08-01 | — | — | CN | disclosed |