SCHEMBL13548833

SCHEMBL13548833

CNCC(=O)C(CC(=O)OC(C)(C)C)c1ccc(OCc2cccc(-c3ccc(F)cc3)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 15/20 0.47
▸ MRGPRX4 Q96LA9 1/20 0.43
▸ PPARD Q03181 2/20 0.42
▸ NR1H2 P55055 2/20 0.42
▸ NR1H3 Q13133 2/20 0.42
▸ GPR34 Q9UPC5 1/20 0.41
▸ RXRA P19793 1/20 0.41
▸ GRM5 P41594 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
SCHEMBL13118135 0.88 FFAR1 (0.48) FFAR1MRGPRX4PPARDNR1H2NR1H3
SCHEMBL13548835 0.88 FFAR1 (0.55) FFAR1MRGPRX4PPARD
SCHEMBL13118134 0.88 FFAR1 (0.52) FFAR1MRGPRX4PPARDNR1H2NR1H3
SCHEMBL13118136 0.88 FFAR1 (0.50) FFAR1MRGPRX4PPARDNR1H2NR1H3
SCHEMBL13118139 0.87 FFAR1 (0.49) FFAR1MRGPRX4PPARDNR1H2NR1H3
SCHEMBL13118141 0.86 FFAR1 (0.48) FFAR1MRGPRX4PPARDNR1H2NR1H3
SCHEMBL3520902 0.80 FFAR1 (0.61) FFAR1MRGPRX4PPARDNR1H2NR1H3
SCHEMBL3523470 0.79 FFAR1 (0.66) FFAR1MRGPRX4PPARDNR1H2NR1H3
SCHEMBL3520170 0.79 FFAR1 (0.62) FFAR1MRGPRX4PPARDNR1H2NR1H3
SCHEMBL3519034 0.77 FFAR1 (0.60) FFAR1MRGPRX4PPARDNR1H2NR1H3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7649110-B2 Compounds, pharmaceutical compositions and methods for use in treating metabolic disorders AMGEN INC. (US) 2010-01-19 — — US disclosed
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