⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21650075 | 0.51 | RAB9A (0.33) | — | |
| SCHEMBL715348 | 0.45 | MEN1 (0.75) | — | |
| SCHEMBL651428 | 0.45 | MEN1 (0.75) | — | |
| SCHEMBL1194020 | 0.44 | TSHR (0.45) | — | |
| Water SCHEMBL25211058 | 0.42 | — | — | |
| Water SCHEMBL3061664 | 0.42 | MEN1 (0.67) | — | |
| Water SCHEMBL18889046 | 0.42 | — | — | |
| Water SCHEMBL21142954 | 0.42 | — | — | |
| Water SCHEMBL15668900 | 0.42 | — | — | |
| Water SCHEMBL21381302 | 0.42 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5530005-A | THERAPY FOR SKIN DISORDERS, AIDS, IMMUNOSUPPRESION DISEASES | SYNTEX (U.S.A.) INC. (US) | 1996-06-25 | — | — | US | disclosed |
| US-5475003-A | Antiinflammatory agent, immunosuppressive, antiallergens, bronchodilators, analgens | SYNTEX (U.S.A.) INC. (US) | 1995-12-12 | — | — | US | disclosed |