⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL470517 | 0.76 | L3MBTL1 (0.31) | — | |
| SCHEMBL28049098 | 0.76 | MEN1 (0.34) | — | |
| SCHEMBL17233342 | 0.76 | — | — | |
| SCHEMBL9282824 | 0.75 | — | — | |
| SCHEMBL429299 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL6594522 | 0.72 | ALOX15 (0.32) | — | |
| SCHEMBL11433065 | 0.71 | — | — | |
| SCHEMBL31163774 | 0.71 | TSHR (0.48) | — | |
| SCHEMBL1030177 | 0.70 | — | — | |
| SCHEMBL28566932 | 0.70 | ALOX15 (0.31) | — |
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-2025096608-A1 | EGFR COVALENT INHIBITION WITH MACROCYCLES | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2025-05-08 | — | — | WO | disclosed |