SCHEMBL5498410

SCHEMBL5498410

CCOc1cc(CN(c2nc3cccc(C(=O)O)c3o2)C2CCNCC2)ccc1C

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.38
SLC6A4 P31645 8/20 0.38
SLC6A3 Q01959 7/20 0.38
KCNH2 Q12809 3/20 0.38
SSTR5 P35346 1/20 0.37
TACR1 P25103 3/20 0.35
KDM4E B2RXH2 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 1/20 0.33
DHODH Q02127 1/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 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
SCHEMBL5486670 0.92 CETP (0.39) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5485960 0.91 SSTR5 (0.38) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL4866640 0.91 MAPT (0.41) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5485921 0.88 PDE10A (0.36) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5492474 0.84 POLB (0.42) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL1121565 0.84 SSTR5 (0.45) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5481894 0.83 SSTR5 (0.38) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5488867 0.83 SSTR5 (0.38) SLC6A2SLC6A4SLC6A3KCNH2SSTR5
SCHEMBL5482720 0.82 SLC6A4 (0.36) SLC6A2SLC6A4SLC6A3KCNH2TACR1
SCHEMBL5483266 0.82 MAPT (0.46) KDM4EMEN1KMT2ANPC1RAB9A

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