Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL7265100 | 0.88 | ALDH1A1 (0.56) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL7272751 | 0.88 | ALDH1A1 (0.56) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL27544391 | 0.85 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8106811 | 0.85 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8787113 | 0.84 | ALDH1A1 (0.49) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL1937359 | 0.79 | GAA (0.51) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL8787955 | 0.79 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL7301260 | 0.74 | MME (0.44) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL11360473 | 0.74 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2AL3MBTL1GAA | |
| SCHEMBL7270563 | 0.74 | ALDH1A1 (0.77) | ALDH1A1MEN1KMT2AL3MBTL1GAA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0729456-B1 | NOVEL PROCESS FOR PREPARING (S)-1-[2(S)-(1,3-DIHYDRO-1,3-DIOXO-ISOINDOL-2-YL)-1-OXO-3-PHENYLPROPYL]-1,2,3,4-TETRAHYDRO-2-PYRIDINE-CARBOXYLIC ACID METHYL ESTER AND INTERMEDIATES THEREOF | MERRELL PHARMA INC (US) | 1997-12-17 | — | — | EP | disclosed |
| EP-0729456-A1 | NOVEL PROCESS FOR PREPARING (S)-1-[2(S)-(1,3-DIHYDRO-1,3-DIOXO-ISOINDOL-2-YL)-1-OXO-3-PHENYLPROPYL]-1,2,3,4-TETRAHYDRO-2-PYRIDINE-CARBOXYLIC ACID METHYL ESTER AND INTERMEDIATES THEREOF | MERRELL PHARMACEUTICALS INC. (US) | 1996-09-04 | — | — | EP | disclosed |
| US-5508411-A | Process for preparing (S)-1-[2(S)-(1,3-dihyrdro-1,3-dioxo-isoindo-2-yl)-1-oxo-3-phenylpropyl]-1,2,3,4,-tetrahydro-2-pyridine-carboxylic acid methyl ester | MERRELL PHARMACEUTICALS INC. | 1996-04-16 | — | — | US | disclosed |
| US-5502253-A | Cyclohex-2-enyl acetamides | MERRELL PHARMACEUTICALS INC. | 1996-03-26 | — | — | US | disclosed |
| WO-1995014663-A2 | NOVEL PROCESS FOR PREPARING (S)-1-[2(S)-(1,3-DIHYDRO-1,3-DIOXO-ISOINDO-2-YL)-1-OXO-3-PHENYLPROPYL]-1,2,3,4-TETRAHYDRO-2-PYRIDINE-CARBOXYLIC ACID METHYL ESTER AND INTERMEDIATES THEREOF | MERRELL PHARMACEUTICALS INC. (US) | 1995-06-01 | — | — | WO | disclosed |