⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL341004 | 0.89 | — | — | |
| SCHEMBL340594 | 0.86 | — | — | |
| SCHEMBL6303418 | 0.79 | TSHR (0.42) | — | |
| SCHEMBL3482469 | 0.79 | LMNA (0.30) | — | |
| SCHEMBL3482412 | 0.78 | — | — | |
| SCHEMBL6303358 | 0.76 | TSHR (0.44) | — | |
| SCHEMBL3481918 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL3481640 | 0.75 | — | — | |
| SCHEMBL12898480 | 0.74 | — | — | |
| SCHEMBL340718 | 0.72 | TSHR (0.33) | — |
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-10752579-B2 | Production method of carbamic acid ester | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2020-08-25 | — | — | US | disclosed |
| US-20190185420-A1 | PRODUCTION METHOD OF CARBAMIC ACID ESTER | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2019-06-20 | — | — | US | disclosed |