⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29934980 | 0.84 | DHCR24 (0.32) | — | |
| SCHEMBL23120144 | 0.72 | ESR2 (0.33) | — | |
| SCHEMBL19924445 | 0.68 | KMT2A (0.32) | — | |
| SCHEMBL16712669 | 0.67 | — | — | |
| SCHEMBL140296 | 0.67 | — | — | |
| SCHEMBL8056802 | 0.67 | — | — | |
| SCHEMBL12760955 | 0.67 | SHBG (0.31) | — | |
| SCHEMBL11510250 | 0.65 | JAK3 (0.37) | — | |
| SCHEMBL14501712 | 0.65 | L3MBTL1 (0.45) | — | |
| SCHEMBL26111758 | 0.65 | SHBG (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023110981-A1 | BIO-BASED EPOXY RESIN COMPOSITION FOR ADHESIVE AND COATINGS APPLICATIONS | FUNDACIÓ INSTITUT CATALÀ D'INVESTIGACIÓ QUÍMICA (ICIQ) (ES) | 2023-06-22 | — | — | WO | disclosed |