SCHEMBL7543713

SCHEMBL7543713

Cc1cn(Cc2ccc(OCc3nc(-c4ccccc4)oc3C)cc2)nc1C

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.59
PPARG P37231 13/20 0.54
PPARA Q07869 12/20 0.54
KDR P35968 1/20 0.53
MAPT P10636 2/20 0.48

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
SCHEMBL7565376 0.86 FFAR1 (0.55) FFAR1PPARGPPARAKDRMAPT
SCHEMBL7571072 0.84 FFAR1 (0.53) FFAR1PPARGPPARAKDRMAPT
SCHEMBL7594843 0.84 FFAR1 (0.57) FFAR1PPARGPPARAKDRMAPT
SCHEMBL7569301 0.84 PPARG (0.53) FFAR1PPARGPPARAKDRMAPT
SCHEMBL5381904 0.83 FFAR1 (0.62) FFAR1PPARGPPARAKDRMAPT
SCHEMBL5377430 0.83 FFAR1 (0.56) FFAR1PPARGPPARAKDRMAPT
SCHEMBL5377024 0.82 FFAR1 (0.55) FFAR1PPARGPPARAKDRMAPT
SCHEMBL5387957 0.81 PPARG (0.59) FFAR1PPARGPPARAKDR
SCHEMBL5385618 0.81 PPARG (0.54) FFAR1PPARGPPARAKDR
SCHEMBL4848532 0.81 KDR (0.56) 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