⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8950520 | 1.00 | — | — | |
| SCHEMBL10653122 | 0.66 | GABRP (0.32) | — | |
| SCHEMBL9677750 | 0.66 | GABRP (0.32) | — | |
| SCHEMBL8950551 | 0.64 | GABRP (0.31) | — | |
| SCHEMBL8950557 | 0.64 | GABRP (0.31) | — | |
| SCHEMBL9510911 | 0.60 | GABRP (0.38) | — | |
| SCHEMBL9511224 | 0.58 | GABRP (0.34) | — | |
| SCHEMBL8950446 | 0.57 | GABRP (0.31) | — | |
| SCHEMBL8950453 | 0.57 | GABRP (0.31) | — | |
| SCHEMBL9910056 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5502073-A | INSECTICIDES OR ANTHELMINTICS | THE WELLCOME FOUNDATION (GB) | 1996-03-26 | — | — | US | disclosed |