SCHEMBL2913504

SCHEMBL2913504

CCOc1cc([C@H](C)NS(C)(=O)=O)ccc1OC

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.59
CA2 P00918 2/20 0.59
ACHE P22303 2/20 0.59
PDE4B Q07343 8/20 0.50
PDE4A P27815 7/20 0.50
PDE4C Q08493 7/20 0.50
PDE4D Q08499 7/20 0.50
CNR2 P34972 6/20 0.44
CNR1 P21554 2/20 0.44
LMNA P02545 1/20 0.44
DRD4 P21917 1/20 0.44
DRD3 P35462 1/20 0.44
HTR6 P50406 1/20 0.44
HIF1A Q16665 1/20 0.43
ALDH1A1 P00352 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL7084187 1.00 CA1 (0.59) CA1CA2ACHEPDE4BPDE4A
SCHEMBL905907 1.00 CA1 (0.59) CA1CA2ACHEPDE4BPDE4A
Levacetylleucine SCHEMBL7085506 0.83 LMNA (0.47) CA1CA2ACHEPDE4BPDE4A
Levacetylleucine SCHEMBL906113 0.83 LMNA (0.47) CA1CA2ACHEPDE4BPDE4A
Levacetylleucine SCHEMBL18263873 0.83 LMNA (0.47) CA1CA2ACHEPDE4BPDE4A
SCHEMBL6876864 0.82 PDE4B (0.54) CA1CA2ACHEPDE4BPDE4A
SCHEMBL18191195 0.82 CA1 (0.42) CA1CA2ACHEPDE4BPDE4A
Ammonia Solution, Strong SCHEMBL18920443 0.81 PDE4B (0.53) CA1CA2ACHEPDE4BPDE4A
Hydrochloric Acid SCHEMBL7618320 0.81 ALDH1A1 (0.51) CA1CA2ACHEPDE4BPDE4A
SCHEMBL23365792 0.80 PDE4B (0.61) PDE4BPDE4APDE4CPDE4D

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016174685-A1 PROCESS FOR THE ENANTIOMERIC RESOLUTION OF APREMILAST INTERMEDIATES MYLAN LABORATORIES LIMITED (IN) 2016-11-03 WO claimed
EP-3341359-A1 PROCESS FOR PREPARATION OF APREMILAST Glenmark Pharmaceuticals Limited (IN) 2018-07-04 EP disclosed
WO-2017070291-A1 PDE4 MODULATORS FOR TREATING AND PREVENTING IMMUNE RECONSTITUTION INFLAMMATORY SYNDROME (IRIS) CELGENE CORPORATION (US) 2017-04-27 WO disclosed
EP-3142663-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ATHEROSCLEROTIC CARDIOVASCULAR DISEASES WITH PDE4 MODULATORS Celgene Corporation (US) 2017-03-22 EP disclosed
EP-3142748-A1 USE OF PDE4 INHIBITORS AND COMBINATIONS THEREOF FOR THE TREATMENT OF CYSTIC FIBROSIS Celgene Corporation (US) 2017-03-22 EP disclosed
WO-2017033116-A1 PROCESS FOR PREPARATION OF APREMILAST GLENMARK PHARMACEUTICALS LIMITED (IN) 2017-03-02 WO disclosed
WO-2016174685-A1 PROCESS FOR THE ENANTIOMERIC RESOLUTION OF APREMILAST INTERMEDIATES MYLAN LABORATORIES LIMITED (IN) 2016-11-03 WO disclosed
WO-2015175773-A1 USE OF PDE4 INHIBITORS AND COMBINATIONS THEREOF FOR THE TREATMENT OF CYSTIC FIBROSIS CELGENE CORPORATION (US) 2015-11-19 WO disclosed
WO-2015175956-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ATHEROSCLEROTIC CARDIOVASCULAR DISEASES WITH PDE4 MODULATORS CELGENE CORPORATION (US) 2015-11-19 WO disclosed
EP-2935226-A1 HETEROARYL COMPOUNDS AND USES THEREOF Celgene Avilomics Research, Inc. (US) 2015-10-28 EP disclosed
WO-2014100748-A1 HETEROARYL COMPOUNDS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-06-26 WO disclosed
EP-2701701-A1 METHODS AND COMPOSITIONS USING PDE4 INHIBITORS FOR THE TREATMENT AND MANAGEMENT OF AUTOIMMUNE AND INFLAMMATORY DISEASES Celgene Corporation (US) 2014-03-05 EP disclosed
EP-2683376-A2 METHODS FOR TREATING DISEASES USING ISOINDOLINE COMPOUNDS Celgene Corporation (US) 2014-01-15 EP disclosed
WO-2012149251-A1 METHODS AND COMPOSITIONS USING PDE4 INHIBITORS FOR THE TREATMENT AND MANAGEMENT OF AUTOIMMUNE AND INFLAMMATORY DISEASES CELGENE CORPORATION (US) 2012-11-01 WO disclosed
WO-2012121988-A2 METHODS FOR TREATING DISEASES USING ISOINDOLINE COMPOUNDS CELGENE CORPORATION (US) 2012-09-13 WO disclosed
EP-2223687-A1 (+)-2-[1-(3-Ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-4-acetylaminoisoindoline-1,3-dione: Methods of Using and Compositions Thereof CELGENE CORPORATION (US) 2010-09-01 EP disclosed
EP-1965793-A1 METHODS FOR TREATING CUTANEOUS LUPUS USING AMINOISOINDOLINE COMPOUNDS CELGENE CORPORATION (US) 2008-09-10 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
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