⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12677815 | 0.88 | — | — | |
| SCHEMBL970150 | 0.82 | — | — | |
| SCHEMBL13254747 | 0.79 | HDAC3 (0.41) | — | |
| SCHEMBL17539032 | 0.77 | — | — | |
| SCHEMBL11273400 | 0.76 | — | — | |
| SCHEMBL19861680 | 0.76 | — | — | |
| SCHEMBL12677814 | 0.73 | HDAC3 (0.31) | — | |
| SCHEMBL6841033 | 0.73 | — | — | |
| SCHEMBL28033411 | 0.73 | — | — | |
| SCHEMBL15107772 | 0.71 | — | — |
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-6764807-B2 | LITHOGRAPHY | KODAK POLYCHROME GRAPHICS LLC | 2004-07-20 | — | — | US | disclosed |
| US-20020086235-A1 | Lithography | EASTMAN KODAK COMPANY | 2002-07-04 | — | — | US | disclosed |
| US-6399271-B1 | HYDROXY CONTAINING COMPOUND WITH AFFINITY FOR INK, AND TITANIUM OR SILICON CONTAINING COMPOUND WITH DIFFERENT AFFINITY FOR INK | KODAK POLYCHROME GRAPHICS LLC | 2002-06-04 | — | — | US | disclosed |
| EP-0377175-A2 | Pattern forming composition and process for forming pattern using the same | HITACHI, LTD. (JP) | 1990-07-11 | — | — | EP | disclosed |