⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19450560 | 0.90 | — | — | |
| SCHEMBL18595868 | 0.88 | — | — | |
| SCHEMBL20283890 | 0.88 | — | — | |
| SCHEMBL18868578 | 0.83 | — | — | |
| SCHEMBL21322779 | 0.83 | — | — | |
| SCHEMBL21558321 | 0.83 | — | — | |
| SCHEMBL22413689 | 0.80 | GAA (0.31) | — | |
| SCHEMBL19303504 | 0.80 | MGLL (0.32) | — | |
| SCHEMBL8606715 | 0.80 | PTGER3 (0.37) | — | |
| SCHEMBL23315749 | 0.79 | ALDH1A1 (0.30) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11116816-B2 | Therapeutic vitamin d conjugates | EXTEND BIOSCIENCES, INC. (US) | 2021-09-14 | — | — | US | disclosed |
| WO-2021046112-A1 | AMINOQUINOLINE COMPOUNDS, IMMUNOCONJUGATES, AND USES THEREOF | BOLT BIOTHERAPEUTICS, INC. (US) | 2021-03-11 | — | — | WO | disclosed |
| WO-2020252254-A1 | MACROMOLECULE-SUPPORTED AMINOBENZAZEPINE COMPOUNDS | BOLT BIOTHERAPEUTICS, INC. (US) | 2020-12-17 | — | — | WO | disclosed |
| US-20190183966-A1 | THERAPEUTIC VITAMIN D CONJUGATES | EXTEND BIOSCIENCES, INC. (US) | 2019-06-20 | — | — | US | disclosed |
| US-9616109-B2 | Insulin vitamin D conjugates | EXTEND BIOSCIENCES, INC. (US) | 2017-04-11 | — | — | US | disclosed |