SCHEMBL13618035

SCHEMBL13618035

Cc1ccc(S(=O)(=O)OOC2CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.55
MMP13 P45452 1/20 0.53
KMT2A Q03164 2/20 0.51
STS P08842 2/20 0.49
MEN1 O00255 1/20 0.47
NPBWR1 P48145 1/20 0.47
MCHR1 Q99705 1/20 0.47
TP53 P04637 1/20 0.46

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
SCHEMBL184777 0.88 CYP2D6 (0.60) GPR119MMP13KMT2ASTSMEN1
SCHEMBL28719877 0.84 CYP2D6 (0.55) GPR119MMP13KMT2ASTSMEN1
SCHEMBL5447212 0.84 CYP2D6 (0.55) GPR119MMP13KMT2ASTSMEN1
SCHEMBL19001727 0.84 CYP2D6 (0.55) GPR119MMP13KMT2ASTSMEN1
SCHEMBL222877 0.83 CYP2D6 (0.54) GPR119MMP13KMT2ASTSMEN1
SCHEMBL221064 0.83 CYP2D6 (0.54) GPR119MMP13KMT2ASTSMEN1
SCHEMBL221063 0.83 CYP2D6 (0.54) GPR119MMP13KMT2ASTSMEN1
SCHEMBL15600231 0.83 GPR119 (0.53) GPR119MMP13KMT2ASTSMEN1
SCHEMBL25213322 0.82 GPR119 (0.58) GPR119MMP13KMT2ASTSTP53
SCHEMBL30750650 0.81 GPR119 (0.51) GPR119MMP13KMT2ASTSMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1943240-B1 CHEMICAL PROCESS ASTRAZENECA AB (SE) 2009-11-11 EP disclosed