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 | |
|---|---|---|---|---|
| SCHEMBL309217 | 0.80 | CYP2D6 (0.47) | CYP2D6CYP2C19 | |
| SCHEMBL29392902 | 0.71 | IDO1 (0.30) | CYP2D6CYP2C19 | |
| Benzoic Acid SCHEMBL22284789 | 0.70 | TSHR (0.37) | CYP2D6CYP2C19 | |
| Benzoic Acid SCHEMBL22284792 | 0.68 | CA2 (0.42) | CYP2D6CYP2C19 | |
| SCHEMBL9385897 | 0.67 | BCAT2 (0.32) | — | |
| SCHEMBL8098453 | 0.67 | CYP2D6 (0.33) | CYP2D6CYP2C19 | |
| SCHEMBL16620225 | 0.66 | ESR1 (0.34) | CYP2D6CYP2C19 | |
| SCHEMBL28743235 | 0.65 | CYP2D6 (0.38) | CYP2D6CYP2C19 | |
| SCHEMBL1022094 | 0.64 | CYP2D6 (0.37) | CYP2D6CYP2C19 | |
| SCHEMBL28177219 | 0.64 | — | — |
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-2167025-A2 | PRESERVATIVE-FREE COMPOSITIONS COMPRISING CINNAMIC OR ANISIC ACID AND A BENZALDEHYDE (DERIVATIVE) | Givaudan SA (CH) | 2010-03-31 | — | — | EP | disclosed |
| WO-2009000097-A2 | PRESERVATIVE-FREE COMPOSITIONS COMPRISING CINNAMIC OR ANISIC ACID AND A BENZALDEHYDE (DERIVATIVE) | GIVAUDAN SA (CH) | 2008-12-31 | — | — | WO | disclosed |