⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23903222 | 0.76 | — | — | |
| SCHEMBL13769069 | 0.74 | — | — | |
| SCHEMBL26027734 | 0.74 | — | — | |
| SCHEMBL14943793 | 0.74 | — | — | |
| SCHEMBL5941021 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL23222789 | 0.72 | — | — | |
| SCHEMBL3788538 | 0.71 | CYP2D6 (0.35) | — | |
| SCHEMBL20968091 | 0.71 | ALDH1A1 (0.32) | — | |
| SCHEMBL13769067 | 0.70 | — | — | |
| SCHEMBL21461220 | 0.67 | TSHR (0.31) | — |
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-20230150921-A1 | PHENOLIC ACID LIPID BASED CATIONIC LIPIDS | TRANSLATE BIO, INC. (US) | 2023-05-18 | — | — | US | disclosed |
| WO-2009083284-A1 | STABILIZATION OF HAIR CLEANING PRODUCTS | HENKEL AG & CO. KGAA (DE) | 2009-07-09 | — | — | WO | disclosed |