SCHEMBL13110438

SCHEMBL13110438

COC(=O)Cc1coc2cc(OCc3cccc(-c4c(C)cccc4C)c3)ccc12

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.82
PPARG P37231 1/20 0.53
PPARD Q03181 1/20 0.53
PPARA Q07869 1/20 0.53
FFAR4 Q5NUL3 1/20 0.51
GNA15 P30679 1/20 0.48

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
SCHEMBL3450258 0.90 FFAR1 (1.00) FFAR1PPARGPPARDPPARAFFAR4
SCHEMBL13110435 0.82 FFAR1 (0.59) FFAR1PPARGPPARDPPARAFFAR4
SCHEMBL5638404 0.79 PPARD (0.72) FFAR1PPARGPPARDPPARA
SCHEMBL10239132 0.79 PPARD (0.60) FFAR1PPARGPPARDPPARA
SCHEMBL16448791 0.78 FFAR1 (0.75) FFAR1PPARGPPARDPPARAGNA15
SCHEMBL1745371 0.76 FFAR1 (0.80) FFAR1FFAR4
SCHEMBL5639128 0.75 PPARD (0.79) FFAR1PPARGPPARDPPARA
SCHEMBL2431256 0.75 ALDH1A1 (0.67)
SCHEMBL15211552 0.75 POLB (0.51) FFAR1PPARDPPARA
SCHEMBL1746739 0.75 FFAR1 (0.69) FFAR1FFAR4GNA15

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
US-7820837-B2 ethyl {6-[(3-phenoxybenzyl)oxy]-3,4-dihydronaphthalen-1-yl}acetate; having a GPR40 receptor function modulating action and being useful as an insulin secretagogue or a pharmaceutical agent for the prophylaxis or treatment of diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed
US-7820837-B2 ethyl {6-[(3-phenoxybenzyl)oxy]-3,4-dihydronaphthalen-1-yl}acetate; having a GPR40 receptor function modulating action and being useful as an insulin secretagogue or a pharmaceutical agent for the prophylaxis or treatment of diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed