⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8400958 | 0.88 | — | — | |
| SCHEMBL8398462 | 0.83 | — | — | |
| SCHEMBL6156344 | 0.81 | — | — | |
| SCHEMBL6156410 | 0.73 | EPHX2 (0.35) | — | |
| SCHEMBL8400949 | 0.67 | — | — | |
| SCHEMBL8916532 | 0.66 | EPHX2 (0.35) | — | |
| SCHEMBL8519519 | 0.65 | CNR2 (0.33) | — | |
| SCHEMBL8401612 | 0.65 | KDM4E (0.35) | — | |
| SCHEMBL6156442 | 0.64 | EPHX2 (0.36) | — | |
| SCHEMBL6156138 | 0.64 | EPHX2 (0.35) | — |
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-0584088-B1 | SUBSTITUTED GUANIDINES AND DERIVATIVES THEREOF AS MODULATORS OF NEUROTRANSMITTER RELEASE AND NOVEL METHODOLOGY FOR IDENTIFYING NEUROTRANSMITTER RELEASE BLOCKERS | CAMBRIDGE NEUROSCIENCE RES (US) | 1999-10-27 | — | — | EP | claimed |