⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL99622 | 0.73 | — | — | |
| SCHEMBL2428258 | 0.73 | — | — | |
| SCHEMBL12154376 | 0.71 | — | — | |
| SCHEMBL2892182 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL10618847 | 0.70 | — | — | |
| Fluoride SCHEMBL4617073 | 0.70 | — | — | |
| SCHEMBL770076 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL5157333 | 0.70 | — | — | |
| Bromide SCHEMBL8507304 | 0.70 | — | — | |
| Water SCHEMBL2817950 | 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-5516662-A | Process for the preparation of headgroup-modified phospholipids using phosphatidylhydroxyalkanols as intermediates | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1996-05-14 | — | — | US | disclosed |
| US-5441876-A | Process for the preparation of headgroup-modified phospholipids using phosphatidylhydroxyalkanols as intermediates | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1995-08-15 | — | — | US | disclosed |