Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN1A | P35498 | 3/20 | 0.62 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.62 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.62 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | EBP | Q15125 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 9/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 4/20 | 0.41 |
| ▸ | HTR2A | P28223 | 4/20 | 0.41 |
| ▸ | HTR2C | P28335 | 4/20 | 0.41 |
| ▸ | HTR2B | P41595 | 4/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.41 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 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 | |
|---|---|---|---|---|
| Anipamil SCHEMBL247837 | 0.81 | SIGMAR1 (0.69) | SCN1ASCN2ASCN3ASIGMAR1EBP | |
| Anipamil SCHEMBL31479919 | 0.81 | SIGMAR1 (0.69) | SCN1ASCN2ASCN3ASIGMAR1EBP | |
| Anipamil SCHEMBL9177433 | 0.80 | SIGMAR1 (0.67) | SCN1ASCN2ASCN3ASIGMAR1EBP | |
| Anipamil SCHEMBL7199272 | 0.80 | SIGMAR1 (0.67) | SCN1ASCN2ASCN3ASIGMAR1EBP | |
| Tiapamil SCHEMBL93936 | 0.79 | SCN1A (1.00) | SCN1ASCN2ASCN3AABCB1CYP3A4 | |
| Tiapamil SCHEMBL635113 | 0.78 | SCN1A (0.98) | SCN1ASCN2ASCN3AABCB1CYP3A4 | |
| SCHEMBL11614948 | 0.78 | SCN1A (0.86) | SCN1ASCN2ASCN3AABCB1CYP3A4 | |
| SCHEMBL25861795 | 0.76 | SCN1A (0.89) | SCN1ASCN2ASCN3AABCB1CYP3A4 | |
| Hydrochloric Acid SCHEMBL11607284 | 0.75 | SCN1A (0.87) | SCN1ASCN2ASCN3AABCB1CYP3A4 | |
| Dagapamil SCHEMBL2110079 | 0.75 | SIGMAR1 (0.60) | SCN1ASCN2ASCN3ASIGMAR1EBP |
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-2430018-A2 | BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYMTHASE INHIBITORS | Novartis AG (CH) | 2012-03-21 | — | — | EP | disclosed |
| WO-2010130773-A2 | BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYMTHASE INHIBITORS | NOVARTIS AG (CH) | 2010-11-18 | — | — | WO | disclosed |