⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10835289 | 0.78 | — | — | |
| SCHEMBL5008766 | 0.77 | CAMK2A (0.35) | — | |
| SCHEMBL4562013 | 0.77 | — | — | |
| SCHEMBL10325546 | 0.76 | CYP3A4 (0.36) | — | |
| SCHEMBL11385818 | 0.76 | CYP3A4 (0.32) | — | |
| SCHEMBL4550536 | 0.74 | HCAR2 (0.38) | — | |
| SCHEMBL11367724 | 0.73 | — | — | |
| SCHEMBL1234336 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL9501577 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL3265447 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1058698-B1 | PREPARATION FOR PREVENTION AND HEALING OF INFLAMMATION AFFECTIONS | USTAV MAKROMOLEKULARNI CHEMIE (CZ) | 2004-07-28 | — | — | EP | claimed |