⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7908107 | 0.72 | CRBN (0.32) | — | |
| SCHEMBL10991806 | 0.62 | NPC1 (0.43) | — | |
| SCHEMBL19175122 | 0.61 | CD38 (0.32) | — | |
| SCHEMBL7795156 | 0.61 | LMNA (0.35) | — | |
| SCHEMBL13895305 | 0.60 | — | — | |
| SCHEMBL13895302 | 0.60 | — | — | |
| SCHEMBL22383936 | 0.59 | CES2 (0.33) | — | |
| SCHEMBL9322086 | 0.58 | HDAC3 (0.30) | — | |
| SCHEMBL27595690 | 0.58 | LMNA (0.33) | — | |
| SCHEMBL13895303 | 0.58 | — | — |
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-8263192-B2 | Methods for modifying surfaces | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2012-09-11 | — | — | US | disclosed |
| US-20070134420-A1 | Methods for modifying surfaces | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2007-06-14 | — | — | US | disclosed |