SCHEMBL5377809

SCHEMBL5377809

CCOC(=O)CCc1cn(Cc2ccc(OCc3ccsc3)cc2)cc1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.40
FFAR4 Q5NUL3 7/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
PTPN1 P18031 2/20 0.38
S1PR5 Q9H228 2/20 0.38
S1PR1 P21453 1/20 0.38

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
SCHEMBL5380592 0.89 FFAR1 (0.50) FFAR1FFAR4
SCHEMBL5377364 0.87 FFAR1 (0.41) FFAR1FFAR4CYP4F2CYP4A11PTPN1
SCHEMBL5372367 0.84 FFAR1 (0.40) FFAR1FFAR4L3MBTL1CYP4F2CYP4A11
SCHEMBL5372016 0.84 L3MBTL1 (0.42) FFAR1FFAR4L3MBTL1CYP4F2CYP4A11
SCHEMBL5377258 0.84 ALDH1A1 (0.48) FFAR1FFAR4L3MBTL1
SCHEMBL5385614 0.83 CYP4F2 (0.48) L3MBTL1CYP4F2CYP4A11PTPN1
SCHEMBL5385157 0.82 FFAR1 (0.44) FFAR1FFAR4CYP4F2CYP4A11S1PR5
SCHEMBL5377471 0.82 FFAR1 (0.40) FFAR1FFAR4CYP4F2CYP4A11PTPN1
SCHEMBL5376983 0.82 PTPN11 (0.41) FFAR1FFAR4L3MBTL1CYP4F2CYP4A11
SCHEMBL5385770 0.82 ALOX5AP (0.43) FFAR1FFAR4CYP4F2CYP4A11

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7179823-B1 5-membered n-heterocyclic compounds with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-20 US disclosed
EP-1457490-A1 5-membered N-heterocyclic compounds with hypoglycemic and hypolipidemic activity Takeda Chemical Industries, Ltd. (JP) 2004-09-15 EP disclosed
EP-1228067-B1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-07-14 EP disclosed
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