⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19983780 | 0.91 | PLK4 (0.30) | — | |
| SCHEMBL19984020 | 0.90 | MTNR1A (0.33) | — | |
| SCHEMBL19983909 | 0.82 | SLC6A2 (0.35) | — | |
| SCHEMBL19984114 | 0.82 | CYP1A2 (0.31) | — | |
| SCHEMBL19983902 | 0.81 | MTNR1A (0.33) | — | |
| SCHEMBL19983901 | 0.80 | TSHR (0.35) | — | |
| SCHEMBL17971552 | 0.79 | HTR6 (0.41) | — | |
| SCHEMBL19984181 | 0.79 | TRPV1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL16619279 | 0.79 | HTR6 (0.41) | — | |
| SCHEMBL19984171 | 0.78 | POLB (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 |
|---|---|---|---|---|---|---|---|
| EP-3052484-B1 | SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME | DAE WOONG PHARMA (KR) | 2018-03-21 | — | — | EP | disclosed |