SCHEMBL29079701

SCHEMBL29079701

CC(C)(C)OC(=O)N1CCC(Oc2ccc(Br)c(Br)n2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.58
CACNB4 O00305 2/20 0.47
CACNA1A O00555 2/20 0.47
CACNA1G O43497 2/20 0.47
CACNG3 O60359 2/20 0.47
CACNA1F O60840 2/20 0.47
CACNA1H O95180 2/20 0.47
CACNB3 P54284 2/20 0.47
CACNA2D1 P54289 2/20 0.47
CACNG7 P62955 2/20 0.47
CACNA1B Q00975 2/20 0.47
CACNA1D Q01668 2/20 0.47
CACNB1 Q02641 2/20 0.47
CACNG1 Q06432 2/20 0.47
CACNB2 Q08289 2/20 0.47
CACNA1S Q13698 2/20 0.47
CACNA1C Q13936 2/20 0.47
CACNA1E Q15878 2/20 0.47
CACNA2D4 Q7Z3S7 2/20 0.47
CACNA2D3 Q8IZS8 2/20 0.47

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
SCHEMBL4269162 0.83 GPR119 (0.55) GPR119CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL30150132 0.83 GPR119 (0.55) GPR119CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL30201512 0.82 GPR119 (0.65) GPR119CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL21607055 0.82 GPR119 (0.67) GPR119CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL940648 0.81 GPR119 (0.66) GPR119NPBWR1MCHR1
SCHEMBL30427128 0.81 GPR119 (0.66) GPR119NPBWR1MCHR1
SCHEMBL17973890 0.81 GPR119 (0.58) GPR119CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL2776764 0.80 GPR119 (0.69) GPR119CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL5469404 0.80 GPR119 (0.57) GPR119CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL3180277 0.80 GPR119 (0.65) GPR119CACNB4CACNA1ACACNA1GCACNG3

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
CN-116406360-A Heterocyclic GLP-1 agonists 加舒布鲁姆生物公司 2023-07-07 CN disclosed