SCHEMBL4049923

SCHEMBL4049923

CC(C)c1noc(N2CCCCC2COc2ccc(-c3ccc(S(=O)(=O)C(C)C)cc3)cc2)n1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.53
GPR183 P32249 1/20 0.52
KCNH2 Q12809 1/20 0.38
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
ATR Q13535 2/20 0.34

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
SCHEMBL387035 0.84 GPR119 (0.73) GPR119GPR183KCNH2ATR
SCHEMBL870014 0.77 GPR119 (0.86) GPR119GPR183KCNH2ATR
SCHEMBL388889 0.76 GPR119 (0.83) GPR119GPR183KCNH2
Hydrochloric Acid SCHEMBL387553 0.76 GPR119 (0.84) GPR119GPR183KCNH2ATR
SCHEMBL1849404 0.72 GPR119 (0.63) GPR119GPR183
SCHEMBL387207 0.71 GPR119 (0.66) GPR119GPR183KCNH2
SCHEMBL870759 0.71 GPR119 (0.66) GPR119GPR183KCNH2ATR
SCHEMBL904156 0.70 GPR119 (0.62) GPR119GPR183KCNH2
SCHEMBL388819 0.70 GPR119 (0.65) GPR119GPR183KCNH2
SCHEMBL387533 0.70 GPR119 (0.65) GPR119GPR183KCNH2

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-2094683-A2 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SmithKline Beecham Corporation (US) 2009-09-02 EP disclosed
WO-2008070692-A2 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SMITHKLINE BEECHAM CORPORATION (US) 2008-06-12 WO disclosed