SCHEMBL15212362

SCHEMBL15212362

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

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 15/20 0.50
PDE4A P27815 10/20 0.50
PDE4C Q08493 10/20 0.50
PDE4D Q08499 10/20 0.50
ALDH1A1 P00352 2/20 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
SCHEMBL6876864 0.82 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DALDH1A1
Ammonia Solution, Strong SCHEMBL18920443 0.81 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL28025842 0.81 PDE4B (0.57) PDE4BPDE4APDE4CPDE4D
SCHEMBL20053105 0.79 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL20448770 0.78 ALDH1A1 (0.46) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL905908 0.78 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL2913506 0.78 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL7084190 0.78 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL28127005 0.78 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL23365792 0.77 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2817289-A2 ASYMMETRIC SYNTHETIC PROCESSES FOR THE PREPARATION OF AMINOSULFONE COMPOUNDS Celgene Corporation (US) 2014-12-31 EP disclosed
WO-2013126495-A2 ASYMMETRIC SYNTHETIC PROCESSES FOR THE PREPARATION OF AMINOSULFONE COMPOUNDS CELGENE CORPORATION (US) 2013-08-29 WO disclosed