⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22374248 | 0.71 | TSHR (0.35) | — | |
| SCHEMBL28641343 | 0.67 | — | — | |
| SCHEMBL7019922 | 0.67 | — | — | |
| SCHEMBL2821288 | 0.67 | — | — | |
| Propane SCHEMBL28111103 | 0.65 | — | — | |
| SCHEMBL4489455 | 0.65 | — | — | |
| SCHEMBL16055345 | 0.63 | — | — | |
| Amylene Hydrate SCHEMBL11774309 | 0.62 | — | — | |
| Dimethylamine SCHEMBL28541414 | 0.62 | TSHR (0.31) | — | |
| Dimethylamine SCHEMBL9053475 | 0.60 | — | — |
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-5124141-A | METHOD FOR DIAGNOSING MALARIA | FLOW INCORPORATED (US) | 1992-06-23 | — | — | US | disclosed |
| WO-1991019974-A1 | METHOD AND COMPOSITION FOR DIAGNOSING MALARIA | FLOW, INC. (US) | 1991-12-26 | — | — | WO | disclosed |