⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25814292 | 0.99 | — | — | |
| SCHEMBL21446771 | 0.97 | ALOX5 (0.30) | — | |
| SCHEMBL25813807 | 0.96 | ALK (0.30) | — | |
| SCHEMBL23375977 | 0.96 | — | — | |
| SCHEMBL25813517 | 0.96 | PTPN1 (0.31) | — | |
| SCHEMBL25814211 | 0.96 | PTPN1 (0.31) | — | |
| SCHEMBL21446458 | 0.95 | PTPN1 (0.30) | — | |
| SCHEMBL17690099 | 0.95 | PIM3 (0.32) | — | |
| SCHEMBL26064607 | 0.94 | — | — | |
| SCHEMBL21446640 | 0.94 | ALK (0.30) | — |
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-20230225196-A1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2023-07-13 | — | — | US | disclosed |
| US-20230225196-A1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2023-07-13 | — | — | US | disclosed |