Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 18/20 | 0.47 |
| ▸ | EBP | Q15125 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7797138 | 0.92 | ESR1 (0.46) | ESR1EBPSIGMAR1AGTR2 | |
| SCHEMBL5851638 | 0.90 | ESR1 (0.47) | ESR1EBPSIGMAR1AGTR2 | |
| SCHEMBL5851634 | 0.88 | ESR1 (0.48) | ESR1 | |
| SCHEMBL5851895 | 0.88 | ESR1 (0.53) | ESR1EBPSIGMAR1 | |
| SCHEMBL5851973 | 0.88 | ESR1 (0.52) | ESR1EBPSIGMAR1 | |
| SCHEMBL5851564 | 0.88 | ESR1 (0.52) | ESR1EBPSIGMAR1 | |
| SCHEMBL5851974 | 0.87 | ESR1 (0.53) | ESR1EBPSIGMAR1 | |
| SCHEMBL5851819 | 0.86 | ESR1 (0.51) | ESR1EBPSIGMAR1 | |
| SCHEMBL5852110 | 0.86 | ESR1 (0.51) | ESR1EBPSIGMAR1 | |
| SCHEMBL5851936 | 0.86 | ESR1 (0.52) | ESR1EBPSIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1098874-A1 | BENZOCYCLOHEPTENES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICAL PREPARATIONS CONTAINING THESE COMPOUNDS, AND THEIR USE FOR PRODUCING MEDICAMENTS | Schering Aktiengesellschaft (DE) | 2001-05-16 | — | — | EP | disclosed |
| WO-2000003979-A1 | BENZOCYCLOHEPTENES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICAL PREPARATIONS CONTAINING THESE COMPOUNDS, AND THEIR USE FOR PRODUCING MEDICAMENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2000-01-27 | — | — | WO | disclosed |