⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3039649 | 0.87 | CA2 (0.34) | — | |
| SCHEMBL3039500 | 0.83 | — | — | |
| SCHEMBL277046 | 0.81 | TSHR (0.31) | — | |
| SCHEMBL9095500 | 0.81 | — | — | |
| SCHEMBL3029506 | 0.73 | — | — | |
| SCHEMBL8462298 | 0.72 | — | — | |
| SCHEMBL3035041 | 0.70 | CHRM1 (0.31) | — | |
| SCHEMBL10104467 | 0.70 | — | — | |
| SCHEMBL8818059 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL3040930 | 0.70 | — | — |
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-8026207-B2 | Peptides and compositions for inhibiting fungal growth | JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) | 2011-09-27 | — | — | US | disclosed |
| US-20090253636-A1 | Novel Antifungal Agent | JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) | 2009-10-08 | — | — | US | disclosed |