⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20848178 | 0.78 | RIPK1 (0.30) | — | |
| SCHEMBL18768793 | 0.76 | CCR2 (0.31) | — | |
| SCHEMBL18768869 | 0.71 | CCR2 (0.32) | — | |
| SCHEMBL240164 | 0.69 | ALDH1A1 (0.37) | — | |
| SCHEMBL18751677 | 0.69 | — | — | |
| SCHEMBL19704801 | 0.69 | CES2 (0.31) | — | |
| SCHEMBL20724934 | 0.69 | CTSB (0.30) | — | |
| SCHEMBL19063261 | 0.68 | RIPK1 (0.32) | — | |
| SCHEMBL8616423 | 0.68 | TSHR (0.46) | — | |
| SCHEMBL20490033 | 0.68 | ALDH1A1 (0.35) | — |
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-11058775-B2 | Insulin dimer-incretin conjugates | MERCK SHARP & DOHME CORP. (US) | 2021-07-13 | — | — | US | disclosed |
| US-20190192675-A1 | INSULIN DIMER-INCRETIN CONJUGATES | MERCK SHARP & DOHME CORP. (US) | 2019-06-27 | — | — | US | disclosed |