⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11816704 | 0.76 | — | — | |
| SCHEMBL6305412 | 0.74 | — | — | |
| SCHEMBL25414445 | 0.72 | CASP6 (0.30) | — | |
| SCHEMBL18092714 | 0.63 | MEN1 (0.30) | — | |
| SCHEMBL28636365 | 0.63 | — | — | |
| SCHEMBL31268406 | 0.61 | — | — | |
| SCHEMBL635693 | 0.61 | ALDH1A1 (0.48) | — | |
| SCHEMBL3192408 | 0.61 | ALDH1A1 (0.51) | — | |
| SCHEMBL19391731 | 0.60 | — | — | |
| SCHEMBL14679661 | 0.60 | — | — |
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-20040106211-A1 | Intelligent electro-optical sensor array and method for analyte detection | TRUSTEES OF TUFTS COLLEGE | 2004-06-03 | — | — | US | disclosed |
| US-6649416-B1 | Comprising fluid-permeable, signal enhancing, porous, textured substrate with open pores; generates optical response when subjected to excitation light energy; enhanced responsivity and selectivity | TRUSTEES OF TUFTS COLLEGE | 2003-11-18 | — | — | US | disclosed |