SCHEMBL1121667

SCHEMBL1121667

CCOc1cc(CN2CCC(Nc3nc4cc(OC(=O)O)ccc4o3)CC2)cc(OCC)c1-c1ccc(F)cc1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 20/20 0.63
KCNH2 Q12809 4/20 0.63
SSTR1 P30872 4/20 0.62
HRH1 P35367 3/20 0.56

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
SCHEMBL1121815 0.94 SSTR5 (0.66) SSTR5KCNH2SSTR1HRH1
SCHEMBL1121677 0.93 SSTR5 (0.62) SSTR5KCNH2SSTR1HRH1
SCHEMBL1121686 0.91 SSTR5 (0.76) SSTR5KCNH2SSTR1HRH1
SCHEMBL1121270 0.90 SSTR5 (0.66) SSTR5KCNH2SSTR1HRH1
SCHEMBL1121269 0.90 SSTR5 (0.78) SSTR5KCNH2SSTR1HRH1
SCHEMBL1121321 0.90 SSTR5 (0.61) SSTR5KCNH2SSTR1HRH1
SCHEMBL1121556 0.89 SSTR5 (0.61) SSTR5KCNH2SSTR1HRH1
SCHEMBL1121446 0.88 SSTR5 (0.59) SSTR5KCNH2SSTR1HRH1
SCHEMBL1121737 0.88 SSTR5 (0.79) SSTR5KCNH2SSTR1HRH1
SCHEMBL1121346 0.87 SSTR5 (0.71) SSTR5KCNH2SSTR1HRH1

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-1924579-B1 BENZOOXAZOLE, OXAZOLOPYRIDINE, BENZOTHIAZOLE AND THIAZOLOPYRIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-02-09 EP claimed