⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10053420 | 1.00 | — | — | |
| SCHEMBL14767651 | 0.78 | TRPA1 (0.30) | — | |
| SCHEMBL18403851 | 0.78 | — | — | |
| SCHEMBL10264633 | 0.77 | — | — | |
| SCHEMBL10073981 | 0.77 | — | — | |
| SCHEMBL805475 | 0.76 | — | — | |
| SCHEMBL18658356 | 0.76 | — | — | |
| SCHEMBL14747957 | 0.72 | — | — | |
| SCHEMBL14959340 | 0.72 | — | — | |
| SCHEMBL14767539 | 0.72 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1790736-A2 | Massive parallel method for decoding DNA and RNA | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2007-05-30 | — | — | EP | disclosed |