⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25776708 | 1.00 | — | — | |
| SCHEMBL3013220 | 1.00 | — | — | |
| SCHEMBL4913066 | 0.85 | CA12 (0.50) | — | |
| SCHEMBL19257447 | 0.85 | CA12 (0.50) | — | |
| SCHEMBL4916594 | 0.85 | CA12 (0.50) | — | |
| SCHEMBL23489714 | 0.85 | CA12 (0.50) | — | |
| SCHEMBL4916813 | 0.85 | CA12 (0.50) | — | |
| SCHEMBL9472346 | 0.84 | — | — | |
| SCHEMBL996641 | 0.82 | CA12 (0.40) | — | |
| SCHEMBL4916951 | 0.82 | KDM4E (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023130070-A2 | CARBOLINE COMPOUNDS AND USE THEREOF | PTC THERAPEUTICS, INC. (US) | 2023-07-06 | — | — | WO | disclosed |
| US-7419990-B2 | Piperidine derivatives as melanocortin-4 receptor agonists | MERCK & CO., INC. (US) | 2008-09-02 | — | — | US | disclosed |
| US-7419990-B2 | Piperidine derivatives as melanocortin-4 receptor agonists | MERCK & CO., INC. (US) | 2008-09-02 | — | — | US | disclosed |