⚠ 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 | |
|---|---|---|---|---|
| Vuf-5296 SCHEMBL7784076 | 1.00 | — | — | |
| Vuf-5297 SCHEMBL7508989 | 1.00 | — | — | |
| Vuf-5296 SCHEMBL6136537 | 1.00 | — | — | |
| Vuf-5296 SCHEMBL8846403 | 1.00 | — | — | |
| SCHEMBL2895063 | 0.80 | — | — | |
| SCHEMBL6136828 | 0.76 | HRH3 (0.46) | — | |
| SCHEMBL2262101 | 0.76 | HRH3 (0.46) | — | |
| SCHEMBL8846230 | 0.75 | — | — | |
| SCHEMBL8846549 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL6782159 | 0.75 | HRH3 (0.45) | — |
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-5652258-A | HISTAMINE ANTAGONISTS | GLIATECH, INC. (US) | 1997-07-29 | — | — | US | disclosed |