⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20537459 | 0.81 | — | — | |
| SCHEMBL20537560 | 0.81 | — | — | |
| SCHEMBL20537457 | 0.75 | — | — | |
| SCHEMBL20537392 | 0.73 | PKM (0.33) | — | |
| SCHEMBL20537561 | 0.73 | — | — | |
| SCHEMBL20537676 | 0.72 | PTGS1 (0.31) | — | |
| SCHEMBL20537404 | 0.72 | PTGS1 (0.31) | — | |
| SCHEMBL18783366 | 0.72 | HTR6 (0.31) | — | |
| SCHEMBL20537510 | 0.70 | — | — | |
| SCHEMBL20537452 | 0.69 | — | — |
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-3079686-B1 | SULFAMATE DERIVATIVE COMPOUND FOR USE IN PREVENTING OR TREATING EPILEPSY | BIO PHARM SOLUTIONS CO LTD (KR) | 2018-10-24 | — | — | EP | claimed |