⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22084730 | 0.60 | KEAP1 (0.41) | — | |
| SCHEMBL22084732 | 0.59 | KDM4E (0.32) | — | |
| SCHEMBL19848387 | 0.58 | L3MBTL1 (0.37) | — | |
| SCHEMBL28548296 | 0.56 | GRM2 (0.38) | — | |
| SCHEMBL20439751 | 0.56 | GRM2 (0.53) | — | |
| SCHEMBL28421250 | 0.54 | TSHR (0.33) | — | |
| SCHEMBL14301805 | 0.50 | CYP1A2 (0.44) | — | |
| SCHEMBL19911464 | 0.49 | GAA (0.40) | — | |
| SCHEMBL14958066 | 0.48 | PDE3B (0.35) | — | |
| SCHEMBL28566639 | 0.48 | CLK4 (0.42) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021194908-A1 | MODIFIED DIPEPTIDE CLEAVASES, USES THEREOF AND RELATED KITS | Encodia, Inc. (US) | 2021-09-30 | — | — | WO | disclosed |
| WO-2020223133-A1 | METHODS AND REAGENTS FOR CLEAVAGE OF THE N-TERMINAL AMINO ACID FROM A POLYPEPTIDE | Encodia, Inc. (US) | 2020-11-05 | — | — | WO | disclosed |
| WO-2020198264-A1 | MODIFIED CLEAVASES, USES THEREOF AND RELATED KITS | Encodia, Inc. (US) | 2020-10-01 | — | — | WO | disclosed |