⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27054564 | 0.86 | — | — | |
| SCHEMBL825094 | 0.82 | — | — | |
| SCHEMBL25698343 | 0.82 | — | — | |
| SCHEMBL34472180 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL828275 | 0.79 | — | — | |
| SCHEMBL24900913 | 0.77 | — | — | |
| SCHEMBL21936117 | 0.77 | — | — | |
| SCHEMBL23993647 | 0.77 | — | — | |
| SCHEMBL18911757 | 0.77 | — | — | |
| SCHEMBL22318070 | 0.71 | DRD4 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024020419-A1 | AZA-QUINAZOLINE COMPOUNDS AND METHODS OF USE | IAMBIC THERAPEUTICS, INC. (US) | 2024-01-25 | — | — | WO | disclosed |
| WO-2022083569-A1 | HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE | AMGEN INC. (US) | 2022-04-28 | — | — | WO | disclosed |