⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1101930 | 0.69 | — | — | |
| SCHEMBL1996650 | 0.69 | — | — | |
| SCHEMBL27997651 | 0.65 | — | — | |
| SCHEMBL14401558 | 0.65 | — | — | |
| SCHEMBL1005554 | 0.64 | — | — | |
| SCHEMBL17085866 | 0.64 | — | — | |
| SCHEMBL3677847 | 0.64 | — | — | |
| SCHEMBL1269917 | 0.62 | — | — | |
| SCHEMBL14920499 | 0.62 | — | — | |
| SCHEMBL6275094 | 0.61 | TSHR (0.57) | — |
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-20180207145-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING DANIRIXIN FOR TREATING INFECTIOUS DISEASES | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED | 2018-07-26 | — | — | US | disclosed |
| CN-1231663-A | Arthropodicidal and fungicidal cyclic amides | DU PONT (US) | 1999-10-13 | — | — | CN | disclosed |