SCHEMBL1745233

SCHEMBL1745233

C/C(=C\C(=O)O)c1cc(F)c(OC2CCc3ccccc32)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.40
PIN1 Q13526 2/20 0.39
IDO1 P14902 2/20 0.38
HSD11B1 P28845 2/20 0.35
CHRM4 P08173 2/20 0.35
DRD2 P14416 2/20 0.35
HTR7 P34969 2/20 0.35
GFRA2 O00451 1/20 0.35
GFRA3 O60609 1/20 0.35
NOX1 Q9Y5S8 1/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL1745236 0.80 AKR1C3 (0.40) FFAR1PIN1IDO1HSD11B1CHRM4
SCHEMBL4261410 0.80 CCR2 (0.42) FFAR1PIN1IDO1
SCHEMBL4261413 0.80 CCR2 (0.42) FFAR1PIN1IDO1
SCHEMBL12320178 0.76 IDO1 (0.51) FFAR1PIN1IDO1
SCHEMBL1746491 0.75 FFAR1 (0.43) FFAR1PIN1IDO1
SCHEMBL1745234 0.75 CCR2 (0.42) FFAR1PIN1IDO1GFRA2GFRA3
SCHEMBL1745230 0.75 CCR2 (0.42) FFAR1PIN1IDO1GFRA2GFRA3
SCHEMBL1746749 0.74 IDO1 (0.49) FFAR1PIN1IDO1
SCHEMBL1744713 0.72 PIN1 (0.40) FFAR1PIN1IDO1GFRA2GFRA3
SCHEMBL12320177 0.70 IDO1 (0.46) FFAR1PIN1IDO1

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-2385032-A1 GPR40 Receptor function regulator Takeda Pharmaceutical Company Limited (JP) 2011-11-09 EP disclosed
US-8008525-B2 For the 14273 peroxisome proliferator activated receptor; antidiabetic agents, hyperlipidemia, obesity or anorexia; receptor binding assay; drug screening kits TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-08-30 US disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed