⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12860203 | 0.59 | — | — | |
| SCHEMBL2355024 | 0.59 | — | — | |
| SCHEMBL11743245 | 0.56 | — | — | |
| Hydrochloric Acid SCHEMBL14812662 | 0.56 | — | — | |
| SCHEMBL27922807 | 0.56 | — | — | |
| SCHEMBL504666 | 0.56 | — | — | |
| SCHEMBL14626492 | 0.56 | — | — | |
| Hydrochloric Acid SCHEMBL9815371 | 0.56 | — | — | |
| SCHEMBL2313975 | 0.56 | — | — | |
| SCHEMBL28029055 | 0.56 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11078177-B2 | Compounds for optically active devices | MERCK PATENT GMBH (DE) | 2021-08-03 | — | — | US | disclosed |