⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14021449 | 0.74 | — | — | |
| SCHEMBL8321738 | 0.74 | TSHR (0.33) | — | |
| SCHEMBL18788896 | 0.74 | — | — | |
| SCHEMBL18814832 | 0.71 | ALOX12 (0.30) | — | |
| SCHEMBL18815082 | 0.71 | ALOX12 (0.30) | — | |
| SCHEMBL14572625 | 0.68 | — | — | |
| SCHEMBL16140256 | 0.66 | — | — | |
| SCHEMBL16140251 | 0.65 | HSD11B1 (0.37) | — | |
| SCHEMBL16140252 | 0.65 | HSD11B1 (0.33) | — | |
| SCHEMBL9676754 | 0.64 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10259800-B2 | Method of fluorination using iodonium ylides | THE GENERAL HOSPITAL CORPORATION (US) | 2019-04-16 | — | — | US | disclosed |
| US-20170121300-A1 | METHOD OF FLUORINATION USING IODONIUM YLIDES | THE GENERAL HOSPITAL CORPORATION | 2017-05-04 | — | — | US | disclosed |
| US-20170121300-A1 | METHOD OF FLUORINATION USING IODONIUM YLIDES | THE GENERAL HOSPITAL CORPORATION | 2017-05-04 | — | — | US | disclosed |