⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2402021 | 0.72 | — | — | |
| SCHEMBL2488573 | 0.71 | — | — | |
| SCHEMBL339906 | 0.71 | — | — | |
| SCHEMBL7935963 | 0.68 | TSHR (0.32) | — | |
| SCHEMBL7935957 | 0.68 | TSHR (0.32) | — | |
| SCHEMBL17329404 | 0.68 | TSHR (0.32) | — | |
| SCHEMBL890924 | 0.67 | — | — | |
| SCHEMBL7536891 | 0.67 | — | — | |
| SCHEMBL18154639 | 0.66 | — | — | |
| SCHEMBL11229957 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016165979-A1 | DIHYDRO-OLIGO-CYCLOPENTADIENYL (METH)ACRYLATES | BASF SE (DE) | 2016-10-20 | — | — | WO | disclosed |