⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9424766 | 1.00 | — | — | |
| SCHEMBL4952421 | 1.00 | — | — | |
| SCHEMBL3398848 | 0.83 | GAPDH (0.60) | — | |
| SCHEMBL3398850 | 0.83 | GAPDH (0.60) | — | |
| SCHEMBL6535825 | 0.80 | — | — | |
| SCHEMBL7132184 | 0.77 | — | — | |
| SCHEMBL7132186 | 0.77 | — | — | |
| SCHEMBL28666917 | 0.76 | GAPDH (0.33) | — | |
| SCHEMBL716187 | 0.75 | — | — | |
| SCHEMBL9179759 | 0.75 | — | — |
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-5332814-A | Process for the preparation of carbacyclic nucleosides, and intermediates | CIBA-GEIGY CORPORATION (US) | 1994-07-26 | — | — | US | disclosed |