⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1797561 | 0.75 | — | — | |
| SCHEMBL1082284 | 0.75 | — | — | |
| SCHEMBL1082306 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL15666046 | 0.73 | — | — | |
| SCHEMBL1170238 | 0.73 | — | — | |
| SCHEMBL18305924 | 0.69 | — | — | |
| SCHEMBL755707 | 0.67 | — | — | |
| SCHEMBL89528 | 0.65 | FNTA (0.31) | — | |
| Phosphoric Acid SCHEMBL16109715 | 0.63 | — | — | |
| SCHEMBL9491664 | 0.61 | TSHR (0.35) | — |
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-7541488-B2 | Process for the preparation of mono- and bis(fluoroalkyl)phosphoranes and the corresponding acids and phosphates | MERCK PATENT GMBH (DE) | 2009-06-02 | — | — | US | disclosed |
| US-20070088176-A1 | Process for the preparation of mono-and bis(fluoroalkyl)phosphoranes and the corresponding acids and phosphates | MERECK PATENT GMBH (DE) | 2007-04-19 | — | — | US | disclosed |