SCHEMBL4953706

SCHEMBL4953706

CCOc1cc(CN2CCC(N3CCC(N(c4nc5cccnc5o4)c4nc5ccc(N)nc5o4)CC3)CC2)cc(OCC)c1N

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 18/20 0.46
HRH1 P35367 4/20 0.40
SSTR1 P30872 1/20 0.40
HTR2B P41595 2/20 0.36
KCNH2 Q12809 1/20 0.35

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
SCHEMBL4955518 0.94 SSTR5 (0.45) SSTR5HRH1HTR2BKCNH2
SCHEMBL4956269 0.92 SSTR5 (0.48) SSTR5HRH1HTR2B
SCHEMBL4957101 0.91 SSTR5 (0.47) SSTR5HRH1SSTR1HTR2BKCNH2
SCHEMBL4955296 0.91 SSTR5 (0.58) SSTR5HRH1HTR2BKCNH2
SCHEMBL4955264 0.81 SSTR5 (0.56) SSTR5HRH1SSTR1HTR2BKCNH2
SCHEMBL4953703 0.80 SSTR5 (0.50) SSTR5HRH1SSTR1HTR2BKCNH2
SCHEMBL4956808 0.77 SSTR5 (0.44) SSTR5HRH1SSTR1HTR2BKCNH2
SCHEMBL4956823 0.77 SSTR5 (0.46) SSTR5HRH1HTR2B
SCHEMBL4958094 0.76 SSTR5 (0.48) SSTR5HRH1SSTR1HTR2BKCNH2
SCHEMBL4958188 0.76 SSTR5 (0.47) SSTR5HRH1SSTR1HTR2BKCNH2

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-1858901-B1 BENZOTHIAZOLE, THIAZOLOPYRIDINE, BENZOOXAZOLE AND OXAZOLOPYRIDINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2008-11-05 EP disclosed