⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10314724 | 0.67 | — | — | |
| SCHEMBL15505384 | 0.64 | — | — | |
| SCHEMBL8132341 | 0.61 | — | — | |
| SCHEMBL458955 | 0.61 | — | — | |
| SCHEMBL12956614 | 0.61 | — | — | |
| SCHEMBL14668872 | 0.61 | — | — | |
| SCHEMBL14066482 | 0.61 | — | — | |
| SCHEMBL7738502 | 0.58 | — | — | |
| SCHEMBL18780116 | 0.58 | — | — | |
| SCHEMBL15182426 | 0.58 | — | — |
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-2021216325-A1 | COMPOSITIONS AND METHODS FOR TREATING METABOLIC AND CARDIOVASCULAR DISEASES | UNIVERSITY OF ROCHESTER (US) | 2021-10-28 | — | — | WO | disclosed |
| WO-2018086139-A1 | CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LIKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS | HANGZHOU DAC BIOTECH CO., LTD (CN) | 2018-05-17 | — | — | WO | disclosed |