⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20158894 | 0.90 | SPHK2 (0.30) | — | |
| SCHEMBL17424318 | 0.83 | — | — | |
| SCHEMBL11694828 | 0.76 | HSD17B10 (0.32) | — | |
| SCHEMBL8965 | 0.76 | SOAT1 (0.37) | — | |
| SCHEMBL22921076 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL21015378 | 0.74 | — | — | |
| SCHEMBL12341240 | 0.74 | SPHK2 (0.48) | — | |
| SCHEMBL21390692 | 0.73 | — | — | |
| SCHEMBL15183698 | 0.72 | — | — | |
| SCHEMBL10281955 | 0.70 | — | — |
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-20230235365-A1 | ENGINEERED RETRONS AND METHODS OF USE | RENAGADE THERAPEUTICS MANAGEMENT INC. (US) | 2023-07-27 | — | — | US | disclosed |
| US-9890198-B2 | Cyclosporin derivatives and uses thereof | S&T GLOBAL INC. (US) | 2018-02-13 | — | — | US | disclosed |