SCHEMBL5485960

SCHEMBL5485960

CCOc1cc(CN(c2nc3cccc(C(=O)O)c3o2)C2CCNCC2)ccc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 1/20 0.38
HRH1 P35367 1/20 0.38
SLC6A2 P23975 7/20 0.37
SLC6A3 Q01959 6/20 0.37
SLC6A4 P31645 6/20 0.37
KCNH2 Q12809 2/20 0.37
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
WDR5 P61964 1/20 0.36
TACR1 P25103 4/20 0.35
CAMKK1 Q8N5S9 1/20 0.35
CAMKK2 Q96RR4 1/20 0.35
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL5481894 0.92 SSTR5 (0.38) SSTR5HRH1SLC6A2SLC6A3SLC6A4
SCHEMBL5482720 0.91 SLC6A4 (0.36) HRH1SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL5498410 0.91 SLC6A2 (0.38) SSTR5SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4866640 0.90 MAPT (0.41) SSTR5HRH1SLC6A2SLC6A3SLC6A4
SCHEMBL5485921 0.90 PDE10A (0.36) SSTR5SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4593259 0.85 SSTR5 (0.42) SSTR5HRH1SLC6A2SLC6A3SLC6A4
SCHEMBL5486981 0.84 SSTR5 (0.37) SSTR5SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL5492474 0.83 POLB (0.42) SSTR5HRH1SLC6A2SLC6A3SLC6A4
SCHEMBL5486670 0.83 CETP (0.39) SSTR5SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL5486178 0.83 KDM4A (0.36) SSTR5SLC6A2SLC6A3SLC6A4KCNH2

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