⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25237741 | 1.00 | — | — | |
| SCHEMBL182779 | 0.88 | SLC22A2 (0.56) | — | |
| SCHEMBL14315587 | 0.82 | SLC22A2 (0.44) | — | |
| SCHEMBL14315572 | 0.82 | SLC22A2 (0.44) | — | |
| SCHEMBL7737331 | 0.78 | GRIN2D (0.48) | — | |
| SCHEMBL21401948 | 0.78 | SLC22A2 (0.36) | — | |
| SCHEMBL20002011 | 0.78 | SLC22A2 (0.36) | — | |
| SCHEMBL2239665 | 0.78 | SLC22A2 (0.36) | — | |
| SCHEMBL20042205 | 0.77 | SMN1; SMN2 (0.42) | — | |
| SCHEMBL20042211 | 0.77 | SMN1; SMN2 (0.42) | — |
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-2025026266-A1 | COMPOUND AS LPAR1 ANTAGONIST, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF | 武汉朗来科技发展有限公司 | 2025-02-06 | — | — | WO | disclosed |