⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16486158 | 0.77 | — | — | |
| SCHEMBL21044602 | 0.72 | — | — | |
| SCHEMBL1220287 | 0.70 | — | — | |
| SCHEMBL1220064 | 0.66 | — | — | |
| SCHEMBL28260633 | 0.61 | — | — | |
| SCHEMBL90094 | 0.61 | — | — | |
| SCHEMBL25922430 | 0.59 | — | — | |
| SCHEMBL7061491 | 0.55 | — | — | |
| SCHEMBL8334582 | 0.55 | — | — | |
| SCHEMBL5849028 | 0.54 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8653233-B2 | Compositions and methods for preventing or treating cancer | UNIVERSITY OF NEBRASKA MEDICAL CENTER (US) | 2014-02-18 | — | — | US | disclosed |
| US-20120270798-A1 | Compositions and Methods for Preventing or Treating Cancer | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2012-10-25 | — | — | US | disclosed |
| US-8193309-B2 | Compositions and methods for preventing or treating cancer | BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) | 2012-06-05 | — | — | US | disclosed |
| US-20100190720-A1 | Compositions and Methods for Preventing or Treating Cancer | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2010-07-29 | — | — | US | disclosed |