SCHEMBL6521247

SCHEMBL6521247

CCOC(=O)C(Cc1ccc(OCCc2cc3ccccc3[nH]2)cc1)C(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.53
PPARA Q07869 7/20 0.53
PPARD Q03181 4/20 0.53
TDP1 Q9NUW8 2/20 0.45
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
DRD3 P35462 2/20 0.43
PDGFRB P09619 1/20 0.43
PDGFRA P16234 1/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
MMP8 P22894 1/20 0.42
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
STAT3 P40763 1/20 0.40

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
SCHEMBL6536575 0.90 PPARG (0.66) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6519515 0.88 PPARG (0.55) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6536271 0.79 NR1H4 (0.55) MTNR1AMTNR1BDRD3PDGFRBPDGFRA
SCHEMBL6516755 0.79 ALDH1A1 (0.50) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6516292 0.78 FFAR1 (0.49) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6521251 0.77 MAPT (0.57) TDP1KMT2AMEN1TSHRMAPK1
SCHEMBL7490651 0.77 PKM (0.55) MTNR1AMTNR1BDRD3PDGFRBPDGFRA
SCHEMBL6516521 0.76 MAPT (0.57) TDP1MTNR1AMTNR1BDRD3PDGFRB
SCHEMBL6523865 0.74 MTNR1A (0.44) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6523869 0.73 MTNR1A (0.43) PPARGPPARAPPARDMTNR1AMTNR1B

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
JP-2005514452-A 2005-05-19 JP claimed
EP-1465858-A2 PHENY(ALKYL)CARBOXYLIC ACID DERIVATIVES AND DIONIC PHENYLALKYLHETEROCYCLIC DERIVATIVES AND THEIR USE AS MEDICINES WITH SERUM GLUCOSE AND/OR SERUM LIPID LOWERING ACTIVITY Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 2004-10-13 EP claimed
WO-2003059864-A2 PHENY(ALKYL)CARBOXYLIC ACID DERIVATIVES AND DIONIC PHENYLALKYLHETEROCYCLIC DERIVATIVES AND THEIR USE AS MEDICINES WITH SERUM GLUCOSE AND/OR SERUM LIPID LOWERING ACTIVITY SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2003-07-24 WO claimed
EP-1465858-A2 PHENY(ALKYL)CARBOXYLIC ACID DERIVATIVES AND DIONIC PHENYLALKYLHETEROCYCLIC DERIVATIVES AND THEIR USE AS MEDICINES WITH SERUM GLUCOSE AND/OR SERUM LIPID LOWERING ACTIVITY Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 2004-10-13 EP disclosed
WO-2003059864-A2 PHENY(ALKYL)CARBOXYLIC ACID DERIVATIVES AND DIONIC PHENYLALKYLHETEROCYCLIC DERIVATIVES AND THEIR USE AS MEDICINES WITH SERUM GLUCOSE AND/OR SERUM LIPID LOWERING ACTIVITY SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2003-07-24 WO disclosed