⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22361086 | 1.00 | — | — | |
| SCHEMBL3254068 | 1.00 | — | — | |
| SCHEMBL19215547 | 0.90 | — | — | |
| SCHEMBL1274004 | 0.88 | KDM4E (0.56) | — | |
| SCHEMBL1443685 | 0.88 | KDM4E (0.56) | — | |
| SCHEMBL4919308 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL2656164 | 0.78 | — | — | |
| SCHEMBL18232482 | 0.75 | SMYD3 (0.41) | — | |
| SCHEMBL27707284 | 0.75 | — | — | |
| SCHEMBL82949 | 0.75 | — | — |
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-11753446-B2 | Beta-hairpin peptidomimetics | POLYPHOR AG (CH) | 2023-09-12 | — | — | US | disclosed |
| US-20200231629-A1 | BETA-HAIRPIN PEPTIDOMIMETICS | POLYPHOR AG (CH) | 2020-07-23 | — | — | US | disclosed |