Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | MMP8 | P22894 | 2/20 | 0.48 |
| ▸ | ACP3 | P15309 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | PPID | Q08752 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11581576 | 0.86 | SMN1; SMN2 (0.45) | SMN1; SMN2KMT2AMEN1NPSR1ALDH1A1 | |
| SCHEMBL11582789 | 0.85 | HIF1A (0.51) | SMN1; SMN2KMT2AMEN1NPSR1ALDH1A1 | |
| SCHEMBL20640584 | 0.84 | SMN1; SMN2 (0.50) | SMN1; SMN2KMT2AMEN1MMP8ALDH1A1 | |
| SCHEMBL5728738 | 0.83 | KMT2A (0.64) | SMN1; SMN2KMT2AMEN1MMP8SIGMAR1 | |
| SCHEMBL30929593 | 0.80 | SMN1; SMN2 (0.53) | SMN1; SMN2KMT2AMEN1MMP8LMNA | |
| SCHEMBL1878484 | 0.80 | SMN1; SMN2 (0.53) | SMN1; SMN2KMT2AMEN1MMP8LMNA | |
| SCHEMBL1878485 | 0.80 | SMN1; SMN2 (0.53) | SMN1; SMN2KMT2AMEN1MMP8LMNA | |
| Hydrochloric Acid SCHEMBL27396543 | 0.79 | SMN1; SMN2 (0.51) | SMN1; SMN2KMT2AMEN1MMP8LMNA | |
| Hydrochloric Acid SCHEMBL27723691 | 0.79 | SMN1; SMN2 (0.51) | SMN1; SMN2KMT2AMEN1MMP8LMNA | |
| SCHEMBL7851021 | 0.79 | SMN1; SMN2 (0.54) | SMN1; SMN2KMT2AMEN1MMP8ALDH1A1 |
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-4075241-A | 2-(Aryl)-3-(dimethylamino)butyl-3,4,5-trimethoxybenzoates | GRUPPO LEPETIT S.P.A. (IT) | 1978-02-21 | — | — | US | disclosed |