SCHEMBL1378950

SCHEMBL1378950

CCOc1cc(CN(c2nc3c(C(N)=O)[c]ccc3o2)C2CCNCC2)ccc1Cl

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 6/20 0.35
SLC6A4 P31645 6/20 0.34
SLC6A2 P23975 5/20 0.34
SLC6A3 Q01959 4/20 0.34
KCNH2 Q12809 3/20 0.34
TACR1 P25103 5/20 0.33
HRH1 P35367 2/20 0.33
HTR2B P41595 1/20 0.33
SSTR1 P30872 1/20 0.31
UTS2R Q9UKP6 1/20 0.31
KDR P35968 1/20 0.31

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
SCHEMBL4863638 0.92 SLC6A2 (0.34) SSTR5SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL5484199 0.92 REN (0.39) SSTR5SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL5488874 0.92 SLC6A2 (0.34) SSTR5SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL5483629 0.91 SLC6A2 (0.34) SSTR5SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL5482006 0.90 SSTR5 (0.32) SSTR5SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL5486745 0.90 SSTR5 (0.35) SSTR5SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL5488923 0.87 SSTR5 (0.30) SSTR5KCNH2
SCHEMBL5487199 0.87 SSTR5 (0.32) SSTR5KCNH2
SCHEMBL5486955 0.85
SCHEMBL5492466 0.84 REN (0.38) SSTR5SLC6A4SLC6A2SLC6A3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4708474-B2 2011-06-22 JP claimed
JP-2008532963-A 2008-08-21 JP claimed
EP-1858901-A1 BENZOTHIAZOLE, THIAZOLOPYRIDINE, BENZOOXAZOLE AND OXAZOLOPYRIDINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2007-11-28 EP claimed
WO-2006094682-A1 BENZOTHIAZOLE, THIAZOLOPYRIDINE, BENZOOXAZOLE AND OXAZOLOPYRIDINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2006-09-14 WO claimed
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