Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | FPR3 | P25089 | 2/20 | 0.32 |
| ▸ | FPR2 | P25090 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL9795402 | 0.94 | KDM4E (0.41) | KDM4ECYP2D6SMN1; SMN2HSD17B10FPR3 | |
| SCHEMBL27837325 | 0.84 | KDM4E (0.41) | KDM4ECYP2D6SMN1; SMN2HSD17B10FPR3 | |
| SCHEMBL10309174 | 0.81 | SMN1; SMN2 (0.45) | KDM4ECYP2D6SMN1; SMN2HSD17B10FPR3 | |
| SCHEMBL9499958 | 0.79 | KDM4E (0.38) | KDM4ECYP2D6SMN1; SMN2HSD17B10FPR3 | |
| SCHEMBL4936016 | 0.77 | KDM4E (0.48) | KDM4ECYP2D6SMN1; SMN2HSD17B10FPR3 | |
| SCHEMBL13463180 | 0.77 | KDM4E (0.43) | KDM4ECYP2D6SMN1; SMN2HSD17B10FPR3 | |
| SCHEMBL9497821 | 0.77 | ALDH1A1 (0.33) | TSHRALDH1A1 | |
| SCHEMBL11518651 | 0.77 | CNR1 (0.38) | SMN1; SMN2HSD17B10TSHRALDH1A1 | |
| SCHEMBL9795415 | 0.76 | KDM4E (0.35) | KDM4ECYP2D6SMN1; SMN2HSD17B10 | |
| Oxalic Acid SCHEMBL9795145 | 0.75 | KDM4E (0.38) | KDM4ECYP2D6SMN1; SMN2HSD17B10 |
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-0367019-B1 | PHARMACEUTICAL COMPOSITIONS CONTAINING NITROXYALKYL AMINE WITH AN AMIDE FUNCTION, AND METHOD FOR THE PREPARATION OF THE COMPOUNDS | Roche Diagnostics GmbH (DE) | 1993-05-12 | — | — | EP | disclosed |
| EP-0367019-A1 | Pharmaceutical compositions containing nitroxyalkyl amine with an amide function, and method for the preparation of the compounds | Roche Diagnostics GmbH (DE) | 1990-05-09 | — | — | EP | disclosed |