Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL25650138 | 0.80 | ALDH1A1 (0.40) | CXCR4 | |
| SCHEMBL272114 | 0.79 | — | — | |
| SCHEMBL40173 | 0.79 | — | — | |
| SCHEMBL2772577 | 0.79 | CXCR4 (0.44) | CXCR4 | |
| SCHEMBL25681947 | 0.78 | NCF1 (0.33) | — | |
| Piperazine SCHEMBL7550059 | 0.77 | CXCR4 (0.48) | CXCR4 | |
| Iodide SCHEMBL9066882 | 0.77 | — | — | |
| SCHEMBL6632282 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL22341586 | 0.77 | CXCR4 (0.43) | CXCR4 | |
| SCHEMBL18828511 | 0.77 | CXCR4 (0.43) | CXCR4 |
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-2002079753-A2 | 2-AMINOBENZOXAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | LION BIOSCIENCE AG (DE) | 2002-10-10 | — | — | WO | disclosed |