Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.65 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL12970709 | 1.00 | ALDH1A1 (0.65) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL3141162 | 0.92 | LMNA (0.57) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL3134886 | 0.86 | MEN1 (0.65) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL12970921 | 0.82 | ALDH1A1 (0.74) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL12970922 | 0.82 | ALDH1A1 (0.74) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL12971020 | 0.82 | ALDH1A1 (0.74) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL12549755 | 0.82 | ALDH1A1 (0.74) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL1953331 | 0.80 | ALDH1A1 (0.75) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL1953330 | 0.80 | ALDH1A1 (0.75) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL3721741 | 0.77 | LMNA (0.63) | ALDH1A1LMNAMEN1KMT2ATSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2507210-B1 | CYCLOHEXANE DERIVATIVES AS INHIBITORS OF ACETYL-COA CARBOXYLASE (ACC) | NOVARTIS AG (CH) | 2015-04-08 | — | — | EP | disclosed |
| US-8394858-B2 | Cyclohexane derivatives and uses thereof | NOVARTIS AG (CH) | 2013-03-12 | — | — | US | disclosed |
| EP-2507210-A1 | CYCLOHEXANE DERIVATIVES AS INHIBITORS OF ACETYL-COA CARBOXYLASE (ACC) | Novartis AG (CH) | 2012-10-10 | — | — | EP | disclosed |