SCHEMBL905908

SCHEMBL905908

CCOc1cc(C(CN)S(C)(=O)=O)ccc1OC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 14/20 0.50
PDE4A P27815 9/20 0.50
PDE4C Q08493 9/20 0.50
PDE4D Q08499 9/20 0.50
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 2/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
ACHE P22303 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL7084190 1.00 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DMAPK1
SCHEMBL2913506 1.00 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DMAPK1
SCHEMBL6876369 0.85 PDE4B (0.45) PDE4BPDE4APDE4CPDE4DMAPK1
SCHEMBL5673767 0.85 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DMAPK1
SCHEMBL31190158 0.84 PDE4A (0.48) PDE4BPDE4APDE4CPDE4DMAPK1
SCHEMBL28048197 0.84 PDE4A (0.48) PDE4BPDE4APDE4CPDE4DMAPK1
SCHEMBL5551736 0.83 PDE4B (0.51) PDE4BPDE4APDE4CPDE4D
SCHEMBL9938956 0.83 SMPD1 (0.47) PDE4BPDE4APDE4CPDE4DMAPK1
SCHEMBL6876864 0.82 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DALDH1A1
Ammonia Solution, Strong SCHEMBL18920443 0.81 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DALDH1A1

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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3307711-A1 PROCESS FOR PREPARATION OF APREMILAST AND ITS INTERMEDIATES Dr. Reddy's Laboratories Ltd. (IN) 2018-04-18 EP claimed
WO-2017033206-A2 SOLID STATE FORMS OF N-[2-[(1 S)-1 -(3-ETHOXY-4-METHOXYPHENYL)-2-(METHYL SULFONYL)ETHYL]-2,3-DIHYDRO-1,3-DIOXO-L H-ISOINDOL-4-YL]ACETAMIDE AND PROCESS FOR PREPARATION THEREOF MSN LABORATORIES PRIVATE LIMITED (IN) 2017-03-02 WO claimed
WO-2016199031-A1 PROCESS FOR PREPARATION OF APREMILAST AND ITS INTERMEDIATES DR. REDDY’S LABORATORIES LIMITED (IN) 2016-12-15 WO claimed
WO-2016174685-A1 PROCESS FOR THE ENANTIOMERIC RESOLUTION OF APREMILAST INTERMEDIATES MYLAN LABORATORIES LIMITED (IN) 2016-11-03 WO claimed
EP-1485087-A1 (+)-2- 1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE: METHODS OF USING AND COMPOSITIONS THEREOF CELGENE CORPORATION (US) 2004-12-15 EP claimed
WO-2003080048-A1 (-)-2-[1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE: METHODS OF USING AND COMPOSITIONS THEREOF CELGENE CORPORATION (US) 2003-10-02 WO claimed
WO-2003080049-A1 (+)-2-[1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE: METHODS OF USING AND COMPOSITIONS THEREOF CELGENE CORPORATION (US) 2003-10-02 WO claimed
EP-3619195-A1 NOVEL PROCESS TO PREPARE N-[2-[(1S)-1-(3-ETHOXY-4-METHOXYPHENYL)-2-(METHYLSULPHONYL) ETHYL]-1, 3-DIOXO-2,3-DIHYDRO-1H-ISOINDOL-4-YL]ACETAMIDE Unichem Laboratories Ltd (IN) 2020-03-11 EP disclosed
WO-2019073431-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF APREMILAST AND ITS INTERMEDIATE Piramal Enterprises Limited (IN) 2019-04-18 WO disclosed
WO-2018203192-A1 NOVEL PROCESS TO PREPARE N-[2-[(1S)-1-(3-ETHOXY-4-METHOXYPHENYL)-2-(METHYLSULPHONYL) ETHYL]-1, 3-DIOXO-2,3-DIHYDRO-1H-ISOINDOL-4-YL]ACETAMIDE UNICHEM LABORATORIES LTD (IN) 2018-11-08 WO disclosed
EP-3373916-A1 CONTROLLED RELEASE ORAL DOSAGE FORMS OF POORLY SOLUBLE DRUGS AND USES THEREOF Celgene Corporation (US) 2018-09-19 EP disclosed
EP-3341359-A1 PROCESS FOR PREPARATION OF APREMILAST Glenmark Pharmaceuticals Limited (IN) 2018-07-04 EP disclosed
EP-3307711-A1 PROCESS FOR PREPARATION OF APREMILAST AND ITS INTERMEDIATES Dr. Reddy's Laboratories Ltd. (IN) 2018-04-18 EP disclosed
WO-2007079182-A1 METHODS FOR TREATING CUTANEOUS LUPUS USING AMINOISOINDOLINE COMPOUNDS CELGENE CORPORATION (US) 2007-07-12 WO disclosed
EP-1485087-A1 (+)-2- 1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE: METHODS OF USING AND COMPOSITIONS THEREOF CELGENE CORPORATION (US) 2004-12-15 EP disclosed
EP-1126839-A4 SUBSTITUTED PHENETHYLSULFONES AND METHOD OF REDUCING TNF ALPHA LEVELS CELGENE CORP (US) 2004-10-27 EP disclosed
WO-2003080048-A1 (-)-2-[1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE: METHODS OF USING AND COMPOSITIONS THEREOF CELGENE CORPORATION (US) 2003-10-02 WO disclosed
WO-2003080049-A1 (+)-2-[1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE: METHODS OF USING AND COMPOSITIONS THEREOF CELGENE CORPORATION (US) 2003-10-02 WO disclosed
EP-1126839-A1 SUBSTITUTED PHENETHYLSULFONES AND METHOD OF REDUCING TNF ALPHA LEVELS CELGENE CORPORATION (US) 2001-08-29 EP disclosed
WO-2000025777-A1 SUBSTITUTED PHENETHYLSULFONES AND METHOD OF REDUCING TNFαLEVELS CELGENE CORPORATION (US) 2000-05-11 WO disclosed