SCHEMBL8312946

SCHEMBL8312946

O=C1NC(=O)C(Cc2ccc(Oc3ccc(Oc4ccc(CC5OC(=O)NC5=O)cc4)cc3)cc2)O1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
CA2 P00918 2/20 0.36
FFAR1 O14842 2/20 0.36
GLA P06280 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HTT P42858 1/20 0.35
PPARG P37231 3/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 1/20 0.34
POLB P06746 1/20 0.34
PPARA Q07869 1/20 0.33
TLR9 Q9NR96 1/20 0.33
BRD4 O60885 1/20 0.32
MEN1 O00255 1/20 0.32
DAO P14920 1/20 0.32

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
SCHEMBL8181635 0.94 CA2 (0.41) CA2FFAR1PPARGKMT2ABRD4
SCHEMBL8315528 0.91 CA2 (0.37) CYP4F2CYP4A11CA2FFAR1HTT
SCHEMBL8957454 0.90 FFAR1 (0.38) CYP4F2CYP4A11CA2FFAR1HTT
SCHEMBL8315754 0.86 FFAR1 (0.48) CYP4F2CYP4A11FFAR1HTTPPARG
SCHEMBL1385865 0.83 ITGB3 (0.45) KMT2AMEN1
SCHEMBL8189509 0.83 GAA (0.53) CYP4F2CYP4A11HTTPPARGKMT2A
SCHEMBL12521895 0.83 CTSK (0.46) CYP4F2CYP4A11CA2FFAR1GLA
SCHEMBL11262445 0.81 MDM2 (0.44) CA2PPARGPOLBDAO
SCHEMBL7217161 0.81 MAPT (0.49) CYP4F2CYP4A11CA2BRD4
SCHEMBL7987893 0.81 CAPN1 (0.41) CA2GAADAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0597102-B1 NOVEL BISHETEROCYCLIC DERIVATIVE OR SALT THEREOF AND HYPOGLYCEMIC COMPOSITION YAMANOUCHI PHARMA CO LTD (JP) 1999-01-07 EP disclosed
US-5508296-A HYPOGLYCEMIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1996-04-16 US disclosed
EP-0597102-A1 NOVEL BISHETEROCYCLIC DERIVATIVE OR SALT THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1994-05-18 EP disclosed