⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11684926 | 0.78 | — | — | |
| SCHEMBL635926 | 0.75 | — | — | |
| SCHEMBL4891328 | 0.72 | — | — | |
| SCHEMBL11783148 | 0.69 | — | — | |
| SCHEMBL28836250 | 0.68 | — | — | |
| SCHEMBL27487975 | 0.67 | — | — | |
| SCHEMBL28320516 | 0.67 | GRM6 (0.32) | — | |
| SCHEMBL3947698 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL31174166 | 0.66 | — | — | |
| SCHEMBL28010220 | 0.65 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007148116-A2 | TOPICAL PHARMACEUTICAL FORMULATIONS | ASTON UNIVERSITY (GB) | 2007-12-27 | — | — | WO | disclosed |
| EP-0757692-A1 | METHANOL DERIVATIVES FOR TREATMENT OF RETROVIRAL INFECTIONS ESPECIALLY HIV INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1997-02-12 | — | — | EP | disclosed |
| WO-1995029922-A1 | METHANOL DERIVATIVES FOR TREATMENT OF RETROVIRAL INFECTIONS ESPECIALLY HIV INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1995-11-09 | — | — | WO | disclosed |