Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7289129 | 0.95 | SLC6A4 (0.46) | SLC6A4SLC6A3SLC6A2CYP2D6SIGMAR1 | |
| SCHEMBL7289449 | 0.88 | KCNH2 (0.45) | SLC6A3KCNH2SIGMAR1OPRM1OPRK1 | |
| SCHEMBL7298566 | 0.86 | SLC6A2 (0.43) | SLC6A4SLC6A3SLC6A2CYP2D6MEN1 | |
| SCHEMBL7291347 | 0.84 | DRD2 (0.42) | SLC6A3 | |
| Fumaric Acid SCHEMBL9147578 | 0.82 | KCNH2 (0.42) | SLC6A4SLC6A3SLC6A2CYP2D6MEN1 | |
| Maleic Acid SCHEMBL9147570 | 0.82 | KCNH2 (0.42) | SLC6A4SLC6A3SLC6A2CYP2D6MEN1 | |
| SCHEMBL7292071 | 0.80 | SIGMAR1 (0.49) | SIGMAR1 | |
| SCHEMBL7294243 | 0.77 | SIGMAR1 (0.43) | SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL7384428 | 0.72 | SLC6A2 (0.48) | SLC6A4SLC6A3SLC6A2MEN1KMT2A | |
| SCHEMBL7290627 | 0.72 | SLC6A2 (0.48) | SLC6A4SLC6A3SLC6A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0458387-B1 | Isochromane derivatives | AKZO NOBEL NV (NL) | 1996-07-03 | — | — | EP | disclosed |
| US-5393759-A | Isochromane derivatives | AKZO N.V. (NL) | 1995-02-28 | — | — | US | disclosed |
| US-5238939-A | Isochromane derivatives | AKZO N.V. (NL) | 1993-08-24 | — | — | US | disclosed |
| EP-0458387-A1 | Isochromane derivatives | Akzo Nobel N.V. (NL) | 1991-11-27 | — | — | EP | disclosed |