SCHEMBL27715465

SCHEMBL27715465

COc1cc(CN2CCC(Nc3nc4cc(S(=O)(=O)O)ccc4o3)CC2)c(OCc2ccccc2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 19/20 0.58
KCNH2 Q12809 2/20 0.58
HRH1 P35367 5/20 0.57
SSTR1 P30872 2/20 0.54
HTR2B P41595 1/20 0.51

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
SCHEMBL3582288 0.92 SSTR5 (0.68) SSTR5KCNH2HRH1SSTR1HTR2B
SCHEMBL27715570 0.91 SSTR5 (0.62) SSTR5KCNH2HRH1SSTR1HTR2B
SCHEMBL3577720 0.88 SSTR5 (0.70) SSTR5HRH1HTR2B
SCHEMBL27715573 0.83 SSTR5 (0.78) SSTR5KCNH2HRH1SSTR1HTR2B
SCHEMBL3571041 0.82 SSTR5 (0.72) SSTR5KCNH2HRH1SSTR1HTR2B
SCHEMBL3578610 0.79 SSTR5 (0.78) SSTR5HRH1HTR2B
SCHEMBL3568789 0.77 SSTR5 (0.78) SSTR5KCNH2HRH1SSTR1HTR2B
SCHEMBL27715355 0.77 SSTR5 (0.75) SSTR5KCNH2HRH1SSTR1HTR2B
SCHEMBL27695335 0.76 SSTR5 (0.75) SSTR5KCNH2HRH1SSTR1
SCHEMBL27715563 0.76 SSTR5 (0.88) SSTR5KCNH2HRH1SSTR1

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
CN-101137660-B Benzothiazole, thiazolopyridine, benzooxazole and oxazolopyridine derivatives as antidiabetic compounds HOFFMANN LA ROCHE 2011-06-15 CN disclosed
CN-101137660-A Benzothiazole, thiazolopyridine, benzooxazole and oxazolopyridine derivatives as antidiabetic compounds HOFFMANN LA ROCHE (CH) 2008-03-05 CN disclosed