⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1114588 | 0.85 | CTSL (0.42) | — | |
| SCHEMBL17399081 | 0.84 | LMNA (0.36) | — | |
| SCHEMBL12790596 | 0.82 | CTSL (0.40) | — | |
| SCHEMBL2294201 | 0.82 | CTSL (0.40) | — | |
| SCHEMBL19773670 | 0.80 | — | — | |
| SCHEMBL14752359 | 0.78 | TSHR (0.56) | — | |
| SCHEMBL19817584 | 0.78 | BHMT (0.38) | — | |
| SCHEMBL12055906 | 0.77 | BHMT (0.38) | — | |
| SCHEMBL23612637 | 0.75 | BHMT (0.41) | — | |
| SCHEMBL20885313 | 0.75 | BHMT (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021012048-A1 | CATALYST FREE, RAPID CURE SILICONE ELASTOMERS | MCMASTER UNIVERSITY (CA) | 2021-01-28 | — | — | WO | disclosed |
| WO-2020243834-A1 | CATALYST FREE SILICONE CURE | MCMASTER UNIVERSITY (CA) | 2020-12-10 | — | — | WO | disclosed |
| WO-2020243835-A1 | TRANSIENT POLYMER NETWORKS | MCMASTER UNIVERSITY (CA) | 2020-12-10 | — | — | WO | disclosed |
| WO-2020163594-A1 | IMMUNOPHILIN BINDING AGENTS AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2020-08-13 | — | — | WO | disclosed |