SCHEMBL7565376

SCHEMBL7565376

COc1cn(Cc2ccc(OCc3nc(-c4ccccc4)oc3C)cc2)nc1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.55
PPARG P37231 12/20 0.51
PPARA Q07869 10/20 0.51
KDR P35968 1/20 0.49
MAPT P10636 4/20 0.48
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL7571072 0.89 FFAR1 (0.53) FFAR1PPARGPPARAKDRMAPT
SCHEMBL7569301 0.88 PPARG (0.53) FFAR1PPARGPPARAKDRMAPT
SCHEMBL7543713 0.86 FFAR1 (0.59) FFAR1PPARGPPARAKDRMAPT
SCHEMBL5377430 0.86 FFAR1 (0.56) FFAR1PPARGPPARAKDRMAPT
SCHEMBL5381904 0.86 FFAR1 (0.62) FFAR1PPARGPPARAKDRMAPT
SCHEMBL7566356 0.85 FFAR1 (0.48) FFAR1PPARGPPARAKDRMAPT
SCHEMBL5396924 0.83 FFAR1 (0.61) FFAR1PPARGPPARAKDR
SCHEMBL5379241 0.83 FFAR1 (0.55) FFAR1PPARGPPARAKDR
SCHEMBL5392112 0.83 FFAR1 (0.53) FFAR1PPARGPPARAKDR
SCHEMBL7594843 0.82 FFAR1 (0.57) FFAR1PPARGPPARAKDRMAPT

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-1228067-A1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGYLCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Chemical Industries, Ltd. (JP) 2002-08-07 EP disclosed
WO-2001038325-A1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-31 WO disclosed