⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16525775 | 0.73 | MAOA (0.40) | — | |
| SCHEMBL23966170 | 0.73 | CARM1 (0.37) | — | |
| SCHEMBL26722006 | 0.71 | FFAR1 (0.38) | — | |
| SCHEMBL19454489 | 0.70 | HSD17B10 (0.37) | — | |
| SCHEMBL23369232 | 0.69 | — | — | |
| SCHEMBL23366503 | 0.69 | KDM4E (0.39) | — | |
| SCHEMBL23366510 | 0.68 | KDM4E (0.35) | — | |
| SCHEMBL23369215 | 0.68 | — | — | |
| SCHEMBL24613028 | 0.67 | — | — | |
| SCHEMBL16525749 | 0.66 | HPGD (0.37) | — |
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-11801528-B2 | Carbene-functionalized composite materials | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2023-10-31 | — | — | US | disclosed |
| US-11383266-B2 | Carbene-functionalized composite materials | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2022-07-12 | — | — | US | disclosed |