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 | |
|---|---|---|---|---|
| SCHEMBL6948132 | 0.81 | RAB9A (0.51) | ALDH1A1 | |
| SCHEMBL5199748 | 0.81 | RAB9A (0.51) | ALDH1A1 | |
| SCHEMBL5199107 | 0.80 | ACHE (0.55) | — | |
| SCHEMBL3865720 | 0.78 | NCEH1 (0.41) | NCEH1ALDH1A1 | |
| SCHEMBL3865739 | 0.78 | NCEH1 (0.41) | NCEH1ALDH1A1 | |
| SCHEMBL5199111 | 0.77 | NCEH1 (0.40) | NCEH1 | |
| SCHEMBL6950959 | 0.76 | RAB9A (0.42) | NCEH1ALDH1A1 | |
| SCHEMBL6950962 | 0.76 | NCEH1 (0.40) | NCEH1 | |
| SCHEMBL6950134 | 0.74 | TSHR (0.47) | ALDH1A1 | |
| SCHEMBL18883617 | 0.70 | NCEH1 (0.44) | NCEH1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1362844-A1 | BENZYLAMINE ANALOGUE | Sankyo Company, Limited (JP) | 2003-11-19 | — | — | EP | disclosed |