⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27136132 | 0.76 | GABRA1 (0.32) | — | |
| SCHEMBL30780154 | 0.76 | GABRA1 (0.32) | — | |
| SCHEMBL30780221 | 0.76 | ABL1 (0.32) | — | |
| SCHEMBL27138379 | 0.76 | ABL1 (0.32) | — | |
| SCHEMBL30780129 | 0.75 | ABL1 (0.32) | — | |
| SCHEMBL27136019 | 0.75 | ABL1 (0.32) | — | |
| SCHEMBL27147741 | 0.73 | TLR7 (0.33) | — | |
| SCHEMBL30780198 | 0.72 | ABL1 (0.39) | — | |
| SCHEMBL27140666 | 0.72 | ABL1 (0.39) | — | |
| SCHEMBL27145381 | 0.67 | S1PR2 (0.30) | — |
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-2024044713-A1 | NAPHTHYRIDINE COMPOUNDS FOR INHIBITION OF RAF KINASES | ENLIVEN INC. (US) | 2024-02-29 | — | — | WO | disclosed |