⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30812621 | 0.84 | — | — | |
| SCHEMBL9061868 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL9061846 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL10842560 | 0.77 | CYP1A2 (0.42) | — | |
| SCHEMBL19722209 | 0.72 | EPHX1 (0.39) | — | |
| SCHEMBL3533683 | 0.67 | — | — | |
| SCHEMBL3533681 | 0.67 | — | — | |
| SCHEMBL13435863 | 0.67 | — | — | |
| SCHEMBL7563785 | 0.67 | — | — | |
| SCHEMBL12062579 | 0.65 | TSHR (0.41) | — |
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-20230227437-A1 | IMMUNOMODULATOR | HITGEN INC (CN) | 2023-07-20 | — | — | US | disclosed |