⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11309012 | 0.71 | — | — | |
| SCHEMBL14818215 | 0.70 | — | — | |
| SCHEMBL17347721 | 0.70 | — | — | |
| SCHEMBL2018808 | 0.68 | — | — | |
| SCHEMBL8359740 | 0.67 | TSHR (0.30) | — | |
| SCHEMBL14769039 | 0.66 | — | — | |
| SCHEMBL15214380 | 0.64 | ALDH1A1 (0.33) | — | |
| SCHEMBL19089068 | 0.64 | — | — | |
| SCHEMBL686782 | 0.64 | — | — | |
| SCHEMBL13981494 | 0.63 | FDPS (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016097231-A2 | INHIBITORY CHIMERIC ANTIGEN RECEPTOR (iCAR OR N-CAR) EXPRESSING NON-T CELL TRANSDUCTION DOMAIN | CELLECTIS (FR) | 2016-06-23 | — | — | WO | disclosed |