⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6032163 | 1.00 | — | — | |
| SCHEMBL364687 | 0.82 | — | — | |
| SCHEMBL31304107 | 0.80 | — | — | |
| SCHEMBL4276134 | 0.80 | NSD2 (0.30) | — | |
| Benzene SCHEMBL28845726 | 0.78 | — | — | |
| SCHEMBL8665715 | 0.75 | — | — | |
| SCHEMBL4441429 | 0.74 | — | — | |
| SCHEMBL10531455 | 0.71 | — | — | |
| Pyrrolidine SCHEMBL28363734 | 0.70 | — | — | |
| SCHEMBL4524582 | 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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3031322-B1 | COMPOSITION COMPRISING HARMFUL ARTHROPOD-ATTRACTING SUBSTANCE FORMED FROM PLANT-DERIVED COMPONENTS AND ANALOGS THEREOF | KYOYU AGRI CO LTD (JP) | 2019-09-11 | — | — | EP | claimed |
| US-6844353-B2 | Fungicidal properties of sampangine and its analogs to agriculturally important fungal plant pathogens | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 2005-01-18 | — | — | US | disclosed |
| WO-2004086861-A2 | FUNGICIDAL PROPERTIES OF SAMPANGINE AND ITS ANALOGS TO AGRICULTURALLY IMPORTANT FUNGAL PLANT PATHOGENS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 2004-10-14 | — | — | WO | disclosed |
| US-20040192721-A1 | Fungicidal properties of sampangine and its analogs to agriculturally important fungal plant pathogens | UNIVERSITY OF MISSISSIPPI, THE | 2004-09-30 | — | — | US | disclosed |
| WO-2003011989-A1 | SOLVENT-FREE LIQUID PIGMENT INK FOR INK-JET PRINTING | ARMOR (FR) | 2003-02-13 | — | — | WO | disclosed |
| EP-0556319-B1 | SAMPANGINE DERIVATIVES USEFUL AS ANTIFUNGAL AGENTS | UNIV MISSISSIPPI (US) | 2000-07-26 | — | — | EP | disclosed |
| EP-0925320-A1 | COATING COMPOSITIONS POLYMERISABLE AND/OR CROSS-LINKABLE BY ULTRAVIOLET OR VISIBLE LIGHT | CRAY VALLEY SA (FR) | 1999-06-30 | — | — | EP | disclosed |
| WO-1998011152-A1 | COATING COMPOSITIONS POLYMERISABLE AND/OR CROSS-LINKABLE BY ULTRAVIOLET OR VISIBLE LIGHT | CRAY VALLEY S.A. (FR) | 1998-03-19 | — | — | WO | disclosed |
| US-5128344-A | SAMPANGINE AND DERIVATIVES USEFUL AS AN ANTIFUNGAL AGENT | UNIVERSITY OF MISSISSIPPI (US) | 1992-07-07 | — | — | US | disclosed |