SCHEMBL5487199

SCHEMBL5487199

CCOc1cc(CN(c2nc3c(C(N)=O)[c]ccc3o2)C2CCNCC2)cc(OCC)c1NC(C)=O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 2/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPK10 P53779 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL5488890 0.91 MEN1 (0.31) SSTR5ALDH1A1
SCHEMBL5482006 0.90 SSTR5 (0.32) SSTR5KCNH2
SCHEMBL4863638 0.87 SLC6A2 (0.34) SSTR5KCNH2
SCHEMBL5488874 0.87 SLC6A2 (0.34) SSTR5ALDH1A1KCNH2
SCHEMBL5484199 0.87 REN (0.39) SSTR5KCNH2
SCHEMBL5488923 0.87 SSTR5 (0.30) SSTR5KCNH2
SCHEMBL5483629 0.87 SLC6A2 (0.34) SSTR5KCNH2
SCHEMBL1378950 0.87 SSTR5 (0.35) SSTR5KCNH2
SCHEMBL5486955 0.85
SCHEMBL5486745 0.85 SSTR5 (0.35) SSTR5KCNH2

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-1858901-A1 BENZOTHIAZOLE, THIAZOLOPYRIDINE, BENZOOXAZOLE AND OXAZOLOPYRIDINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2007-11-28 EP disclosed
WO-2006094682-A1 BENZOTHIAZOLE, THIAZOLOPYRIDINE, BENZOOXAZOLE AND OXAZOLOPYRIDINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2006-09-14 WO disclosed