SCHEMBL3045244

SCHEMBL3045244

CSCCCOc1cc(C)c(-c2cc(COc3ccc4c(c3)OC[C@H]4OC(C)=O)c(F)cc2OCc2ccccc2)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 0.47
GNA15 P30679 1/20 0.43
SLC10A1 Q14973 1/20 0.43
ABCC2 Q92887 1/20 0.43
SLCO1B3 Q9NPD5 1/20 0.43
SLCO1B1 Q9Y6L6 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
SCHEMBL204830 0.89 FFAR1 (0.47) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL3008775 0.88 FFAR1 (0.62) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL2690136 0.87 FFAR1 (0.55) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL14344065 0.85 FFAR1 (0.51) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL203274 0.80 FFAR1 (0.56) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL206778 0.78 FFAR1 (0.71) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL765390 0.78 FFAR1 (0.71) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL205213 0.77 FFAR1 (0.41) FFAR1
SCHEMBL2690535 0.77 FFAR1 (0.63) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL15397937 0.75 FFAR1 (0.60) FFAR1GNA15SLC10A1ABCC2SLCO1B3

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-2248812-B1 FUSED CYCLIC COMPOUNDS AS GPR40 RECEPTOR MODULATORS TAKEDA PHARMACEUTICAL (JP) 2013-12-25 EP disclosed
EP-2248812-A2 Fused cyclic compounds as GPR40 receptor modulators Takeda Pharmaceutical Company Limited (JP) 2010-11-10 EP disclosed