Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 6/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12852098 | 0.84 | SMN1; SMN2 (0.41) | MEN1KMT2ASMN1; SMN2POLBLMNA | |
| SCHEMBL31544733 | 0.84 | SMN1; SMN2 (0.41) | MEN1KMT2ASMN1; SMN2POLBLMNA | |
| SCHEMBL3789681 | 0.81 | SMN1; SMN2 (0.44) | MEN1KMT2ASMN1; SMN2POLBLMNA | |
| SCHEMBL3398998 | 0.79 | MEN1 (0.50) | MEN1KMT2ASMN1; SMN2POLBLMNA | |
| SCHEMBL1645546 | 0.78 | TSHR (0.60) | POLBLMNAALDH1A1GAAMAPT | |
| SCHEMBL14044063 | 0.78 | TSHR (0.41) | MEN1KMT2ASMN1; SMN2POLBLMNA | |
| SCHEMBL12895731 | 0.78 | ALDH1A1 (0.40) | MEN1KMT2ASMN1; SMN2POLBLMNA | |
| Hydrochloric Acid SCHEMBL6518247 | 0.78 | MEN1 (0.48) | MEN1KMT2ASMN1; SMN2POLBLMNA | |
| SCHEMBL25318451 | 0.77 | SMN1; SMN2 (0.40) | MEN1KMT2ASMN1; SMN2POLBLMNA | |
| SCHEMBL2018693 | 0.76 | LMNA (0.49) | MEN1KMT2ASMN1; SMN2POLBLMNA |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3204383-A1 | SPIRODIAMINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2017-08-16 | — | — | EP | disclosed |
| WO-2016055394-A1 | SPIRODIAMINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2016-04-14 | — | — | WO | disclosed |
| EP-3004089-A1 | NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS | F.HOFFMANN-LA ROCHE AG (CH) | 2016-04-13 | — | — | EP | disclosed |
| EP-3004076-A1 | NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2016-04-13 | — | — | EP | disclosed |
| EP-3004077-A1 | NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2016-04-13 | — | — | EP | disclosed |
| WO-2014191338-A1 | NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2014-12-04 | — | — | WO | disclosed |
| WO-2014191340-A1 | NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2014-12-04 | — | — | WO | disclosed |
| WO-2014191336-A1 | NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2014-12-04 | — | — | WO | disclosed |