⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3698991 | 0.71 | — | — | |
| SCHEMBL26215787 | 0.69 | — | — | |
| SCHEMBL419403 | 0.67 | — | — | |
| SCHEMBL313460 | 0.67 | — | — | |
| SCHEMBL31174817 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL28729360 | 0.64 | — | — | |
| SCHEMBL3030498 | 0.64 | — | — | |
| SCHEMBL28305091 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL11751862 | 0.64 | — | — | |
| SCHEMBL10534185 | 0.64 | — | — |
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-5504204-A | IMMUNOSUPPRESSIVE, ANTIINFLAMMATORY, ANTIFUNGAL, ANTIPROLIFERATIVE AND ANTITUMOR AGENTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-04-02 | — | — | US | disclosed |