Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | F10 | P00742 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6956525 | 0.87 | NPSR1 (0.48) | ALDH1A1SMN1; SMN2RAB9AKDM4ENFKB1 | |
| SCHEMBL8667637 | 0.81 | RAB9A (0.75) | ALDH1A1SMN1; SMN2RAB9AKDM4EKMT2A | |
| SCHEMBL6959327 | 0.75 | KMT2A (0.41) | ALDH1A1SMN1; SMN2RAB9AKDM4ECYP2C9 | |
| SCHEMBL10956804 | 0.74 | MAPK1 (0.55) | ALDH1A1SMN1; SMN2RAB9AKDM4ECYP2C9 | |
| SCHEMBL6957318 | 0.73 | ACHE (0.46) | ALDH1A1SMN1; SMN2RAB9AKDM4EKMT2A | |
| SCHEMBL9002518 | 0.72 | F10 (0.72) | ALDH1A1SMN1; SMN2RAB9AKDM4EKMT2A | |
| SCHEMBL23832652 | 0.71 | SMN1; SMN2 (0.59) | ALDH1A1SMN1; SMN2RAB9AKMT2AL3MBTL1 | |
| SCHEMBL21069745 | 0.71 | SMN1; SMN2 (0.59) | ALDH1A1SMN1; SMN2RAB9AKMT2AL3MBTL1 | |
| SCHEMBL19268078 | 0.70 | KMT2A (0.54) | ALDH1A1SMN1; SMN2RAB9AKDM4ECYP3A4 | |
| SCHEMBL27469650 | 0.70 | HCAR2 (0.59) | ALDH1A1SMN1; SMN2RAB9AKDM4ECYP3A4 |
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-0567026-B1 | 4,1-Benzoxazepin derivatives as squalene synthase inhibitors and their use in the treatment of hypercholesteremia and as fungicides | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-03-26 | — | — | EP | disclosed |
| US-5885979-A | SQUALENE SYNTHETASE INHIBITOR TREATING OR PREVENTING HYPERLIPIDEMIA | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-03-23 | — | — | US | disclosed |
| US-5726306-A | INHIBITORS OF SQUALENE SYNTHETASE AND FUNGAL GROWTH; USEFUL IN TREATING AND PREVENTING HYPERLIPIDEMIA | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-03-10 | — | — | US | disclosed |
| EP-0567026-A1 | 4,1-Benzoxazepin derivatives as squalene synthase inhibitors and their use in the treatment of hypercholesteremia and as fungicides | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1993-10-27 | — | — | EP | disclosed |