SCHEMBL5483629

SCHEMBL5483629

CCOc1cc(CN(c2nc3c(C(N)=O)[c]ccc3o2)C2CCNCC2)ccc1F

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.34
SLC6A4 P31645 6/20 0.34
SLC6A3 Q01959 4/20 0.34
KCNH2 Q12809 3/20 0.34
SSTR5 P35346 3/20 0.33
HRH1 P35367 2/20 0.33
TACR1 P25103 4/20 0.32
SLC6A9 P48067 1/20 0.31
SLC6A5 Q9Y345 1/20 0.31
REN P00797 1/20 0.30
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL5484199 0.92 REN (0.39) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL4863638 0.92 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5488874 0.92 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5486745 0.91 SSTR5 (0.35) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL1378950 0.91 SSTR5 (0.35) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5482006 0.90 SSTR5 (0.32) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5487199 0.87 SSTR5 (0.32) KCNH2SSTR5
SCHEMBL5488923 0.87 SSTR5 (0.30) KCNH2SSTR5
SCHEMBL5486955 0.85
SCHEMBL5486117 0.85 REN (0.41) SLC6A2SLC6A4SLC6A3SSTR5REN

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