Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8075909 | 1.00 | ALDH1A1 (0.61) | ALDH1A1GAATDP1POLBL3MBTL1 | |
| SCHEMBL7284629 | 1.00 | ALDH1A1 (0.61) | ALDH1A1GAATDP1POLBL3MBTL1 | |
| SCHEMBL8283041 | 0.89 | TDP1 (0.51) | ALDH1A1GAATDP1POLBL3MBTL1 | |
| SCHEMBL8283049 | 0.87 | CASP3 (0.50) | ALDH1A1GAATDP1POLBL3MBTL1 | |
| SCHEMBL13937943 | 0.85 | TDP1 (0.58) | ALDH1A1GAATDP1POLBL3MBTL1 | |
| SCHEMBL7796562 | 0.85 | TDP1 (0.58) | ALDH1A1GAATDP1POLBL3MBTL1 | |
| SCHEMBL7797911 | 0.85 | TDP1 (0.58) | ALDH1A1GAATDP1POLBL3MBTL1 | |
| SCHEMBL12834925 | 0.83 | ALDH1A1 (0.65) | ALDH1A1GAATDP1POLBL3MBTL1 | |
| SCHEMBL28798215 | 0.80 | TDP1 (0.47) | ALDH1A1GAATDP1POLBL3MBTL1 | |
| SCHEMBL10588010 | 0.79 | ALDH1A1 (0.61) | ALDH1A1GAATDP1POLBL3MBTL1 |
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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0778827-B1 | PROCESS FOR PRODUCING A BETA-AMINO ALCOHOL | DEGUSSA (DE) | 2001-12-12 | — | — | EP | claimed |
| US-5994555-A | (4S,5S)-4-BENZYL-2-OXO-OXAZOLIDINE-5-CARBOXYLIC ACID FROM PHENYLALANINE AND PHTHALIC ANHYDRIDE | F. HOFFMAN-LAROCHE AG (CH) | 1999-11-30 | — | — | US | claimed |
| US-5859248-A | Process for the production of a β-amino alcohol | F. HOFFMAN-LA ROCHE AG (CH) | 1999-01-12 | — | — | US | claimed |
| EP-0778827-A1 | PROCESS FOR PRODUCING A BETA-AMINO ALCOHOL | F. HOFFMANN-LA ROCHE AG (CH) | 1997-06-18 | — | — | EP | claimed |
| WO-1996007642-A1 | PROCESS FOR PRODUCING A β-AMINO ALCOHOL | F. HOFFMANN-LA ROCHE AG (DE) | 1996-03-14 | — | — | WO | claimed |
| EP-0635493-A2 | Process for the preparationof a beta-aminoalcohol | F. HOFFMANN-LA ROCHE AG (CH) | 1995-01-25 | — | — | EP | claimed |
| EP-0778827-B1 | PROCESS FOR PRODUCING A BETA-AMINO ALCOHOL | DEGUSSA (DE) | 2001-12-12 | — | — | EP | disclosed |
| US-5994555-A | (4S,5S)-4-BENZYL-2-OXO-OXAZOLIDINE-5-CARBOXYLIC ACID FROM PHENYLALANINE AND PHTHALIC ANHYDRIDE | F. HOFFMAN-LAROCHE AG (CH) | 1999-11-30 | — | — | US | disclosed |
| US-5919949-A | α-hydroxy acid esters useful as intermediates in the production of β-amino alcohols | HOFFMANN-LA ROCHE INC. (US) | 1999-07-06 | — | — | US | disclosed |
| US-5859248-A | Process for the production of a β-amino alcohol | F. HOFFMAN-LA ROCHE AG (CH) | 1999-01-12 | — | — | US | disclosed |
| EP-0738724-B1 | Process for the preparation of an N-terbutylamide derivative | HOFFMANN LA ROCHE (CH) | 1998-11-04 | — | — | EP | disclosed |
| US-5698698-A | Process for preparation of N-tert.butyl-decahydro-2- 2(R)-hydroxy-4-phenyl-3(S)-phthalimidobutyl!-(4aS,8aS)-isoquinoline-3(S)-carboxamide | HOFFMANN-LA ROCHE INC. (US) | 1997-12-16 | — | — | US | disclosed |
| US-5641886-A | Process for preparation of N-tert.butyl-decahydro-2-[2(R)-hydroxy-4-phenyl-3(S)-phthalimidobutyl]-(4AS,8AS)-isoquinoline-3(S)-carboxamide | HOFFMANN-LA ROCHE INC. (US) | 1997-06-24 | — | — | US | disclosed |
| US-5502210-A | 1H-isoindole-1,3-dione compounds | HOFFMANN-LA ROCHE INC. (US) | 1996-03-26 | — | — | US | disclosed |
| WO-1996007642-A1 | PROCESS FOR PRODUCING A β-AMINO ALCOHOL | F. HOFFMANN-LA ROCHE AG (DE) | 1996-03-14 | — | — | WO | disclosed |
| US-5495025-A | Isoindole compounds which are useful as intermediates | HOFFMANN-LA ROCHE INC. (US) | 1996-02-27 | — | — | US | disclosed |
| US-5455353-A | 4-(benzyl-2-oxo-oxazolidin-5 ylmethyl)N tertbutyl-decahydroisoquinoline-3-carboxamides | HOFFMANN-LA ROCHE INC. (US) | 1995-10-03 | — | — | US | disclosed |
| EP-0635493-A2 | Process for the preparationof a beta-aminoalcohol | F. HOFFMANN-LA ROCHE AG (CH) | 1995-01-25 | — | — | EP | disclosed |
| EP-0634410-A1 | Process for the preparation of a N-tert.butylisoquinolin-3-carboxamide derivative and intermediate compounds of these process | F. HOFFMANN-LA ROCHE AG (CH) | 1995-01-18 | — | — | EP | disclosed |
| US-4973585-A | INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME | MERRELL DOW PHARMACEUTICALS (US) | 1990-11-27 | — | — | US | disclosed |