⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14960443 | 0.79 | — | — | |
| SCHEMBL19657435 | 0.69 | ERBB2 (0.35) | — | |
| SCHEMBL22173844 | 0.67 | — | — | |
| SCHEMBL22642297 | 0.67 | MAPT (0.32) | — | |
| SCHEMBL14256585 | 0.66 | — | — | |
| SCHEMBL5089878 | 0.65 | — | — | |
| SCHEMBL13903218 | 0.65 | — | — | |
| SCHEMBL13376703 | 0.61 | — | — | |
| SCHEMBL14417640 | 0.61 | — | — | |
| SCHEMBL522896 | 0.59 | — | — |
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-20160367961-A1 | METHOD AND COMPOSITION FOR PEPTIDE CYCLIZATION AND PROTEASE TREATMENT | Roche Sequencing Solutions, Inc. | 2016-12-22 | — | — | US | disclosed |
| US-20160312212-A1 | COW ANTIBODY SCAFFOLD POLYPEPTIDE METHOD AND COMPOSITION | Roche Sequencing Solutions, Inc. | 2016-10-27 | — | — | US | disclosed |