SCHEMBL5484863

SCHEMBL5484863

CCOc1cc(CN(c2nc3cc(NC(C)=O)ccc3o2)C2CCNCC2)ccc1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 10/20 0.57
HRH1 P35367 3/20 0.48
SSTR1 P30872 1/20 0.48
KDR P35968 3/20 0.41
HDAC6 Q9UBN7 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
MET P08581 1/20 0.40
GRK2 P25098 1/20 0.40
GRK5 P34947 1/20 0.40
KCNH2 Q12809 2/20 0.40
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL5485744 0.88 SSTR5 (0.49) SSTR5HRH1SSTR1KDRHDAC6
SCHEMBL5485903 0.87 HDAC6 (0.46) SSTR5HRH1SSTR1HDAC6LMNA
SCHEMBL4594185 0.85 SSTR5 (0.42) SSTR5HRH1SSTR1HDAC6SMN1; SMN2
SCHEMBL4594763 0.85 SSTR5 (0.41) SSTR5HRH1SSTR1HDAC6KCNH2
SCHEMBL4593246 0.84 SSTR5 (0.41) SSTR5HRH1SSTR1HDAC6SMN1; SMN2
SCHEMBL4594457 0.84 SSTR5 (0.39) SSTR5HRH1SSTR1HDAC6SMN1; SMN2
SCHEMBL1379151 0.83 SSTR5 (0.56) SSTR5HRH1SSTR1HDAC6KDM4E
SCHEMBL4594278 0.83 MAPT (0.46) SSTR5HRH1HDAC6KDM4ELMNA
SCHEMBL4593310 0.83 REN (0.41) SSTR5HRH1SSTR1HDAC6KCNH2
SCHEMBL1381181 0.83 SSTR5 (0.49) SSTR5HRH1SSTR1SMN1; SMN2KDM4E

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