SCHEMBL1746691

SCHEMBL1746691

CCC(Cc1c(OC)cc(OCc2cccc(Oc3ccccc3)c2)cc1OC)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.57
PPARG P37231 8/20 0.57
PPARD Q03181 5/20 0.52
FFAR1 O14842 6/20 0.48
FFAR4 Q5NUL3 2/20 0.47
MME P08473 1/20 0.44
ACE P12821 1/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
EPHX2 P34913 1/20 0.43
CETP P11597 1/20 0.43

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
SCHEMBL1745593 0.80 FFAR1 (0.67) FFAR1FFAR4
SCHEMBL1745591 0.80 FFAR1 (0.51) PPARAPPARGFFAR1FFAR4
SCHEMBL1746694 0.79 FFAR1 (0.56) PPARAPPARGFFAR1FFAR4CETP
SCHEMBL12571107 0.78 FFAR1 (0.52) FFAR1FFAR4
SCHEMBL28087440 0.78 MME (0.60) PPARAPPARGPPARDFFAR1MME
SCHEMBL1746690 0.75 FFAR1 (0.48) PPARGFFAR1FFAR4CETP
SCHEMBL10795614 0.74 MMP1 (0.54) PPARAPPARGFFAR1FFAR4MME
SCHEMBL28893490 0.73 CYP1A2 (0.65) PPARAPPARGFFAR1FFAR4MME
SCHEMBL1746794 0.73 TDP1 (0.50) PPARAPPARGPPARD
SCHEMBL1745480 0.72 FFAR1 (0.69) FFAR1FFAR4

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-2385032-A1 GPR40 Receptor function regulator Takeda Pharmaceutical Company Limited (JP) 2011-11-09 EP disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed