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 | |
|---|---|---|---|---|
| SCHEMBL4010930 | 0.68 | CYP2D6 (0.54) | CYP2D6CYP2C19 | |
| SCHEMBL17821044 | 0.67 | — | — | |
| SCHEMBL3122875 | 0.66 | CYP2D6 (0.41) | CYP2D6CYP2C19 | |
| SCHEMBL1696901 | 0.62 | — | — | |
| SCHEMBL9007638 | 0.62 | CYP2D6 (0.38) | CYP2D6CYP2C19 | |
| SCHEMBL23354398 | 0.59 | HDAC3 (0.43) | CYP2D6CYP2C19 | |
| SCHEMBL23354478 | 0.59 | CYP2D6 (0.48) | CYP2D6CYP2C19 | |
| Ammonia Solution, Strong SCHEMBL3170528 | 0.59 | — | — | |
| SCHEMBL7365518 | 0.58 | CYP2D6 (0.46) | CYP2D6CYP2C19 | |
| SCHEMBL7603449 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5523463-A | Method of producing halogenated and alpha-aminoalchohols | HOFFMANN-LA ROCHE INC. (US) | 1996-06-04 | — | — | US | disclosed |