⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11690387 | 0.83 | GAA (0.30) | — | |
| SCHEMBL11690379 | 0.82 | — | — | |
| SCHEMBL11688527 | 0.76 | CYP1A2 (0.33) | — | |
| SCHEMBL6400356 | 0.73 | CA2 (0.33) | — | |
| SCHEMBL6405654 | 0.73 | TTR (0.36) | — | |
| SCHEMBL6401055 | 0.73 | TTR (0.36) | — | |
| SCHEMBL6405651 | 0.72 | CA2 (0.33) | — | |
| SCHEMBL11688529 | 0.68 | SLC2A1 (0.32) | — | |
| SCHEMBL30364675 | 0.67 | CYP1A2 (0.43) | — | |
| SCHEMBL7175125 | 0.59 | CA2 (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4013635-A | COLOR DIFFUSION TRANSFER PHOTOGRAPHY | EASTMAN KODAK COMPANY (US) | 1977-03-22 | — | — | US | disclosed |