⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1277062 | 0.80 | — | — | |
| Water SCHEMBL22654522 | 0.77 | ACHE (0.35) | — | |
| Bromide SCHEMBL27774766 | 0.77 | SMN1; SMN2 (0.36) | — | |
| Iodide SCHEMBL28884004 | 0.77 | SMN1; SMN2 (0.38) | — | |
| Perchlorate SCHEMBL11802589 | 0.74 | POLB (0.40) | — | |
| SCHEMBL21732329 | 0.72 | KDM4E (0.40) | — | |
| SCHEMBL898960 | 0.72 | — | — | |
| SCHEMBL17286403 | 0.72 | — | — | |
| SCHEMBL15934912 | 0.69 | PNMT (0.31) | — | |
| SCHEMBL18560876 | 0.68 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240092739-A1 | COMPOUNDS AND METHODS OF USE | VENTHERA, INC. | 2024-03-21 | — | — | US | disclosed |
| WO-2022042657-A1 | COMPOUNDS AND METHODS OF USE | Ferro Therapeutics, Inc. (US) | 2022-03-03 | — | — | WO | disclosed |