SCHEMBL28023966

SCHEMBL28023966

CCCCCCCN(CCc1ccc(O)cc1)C(=O)Nc1ccc(F)cc1F

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.72
PPARA Q07869 3/20 0.72
PPARD Q03181 1/20 0.72
SOAT1 P35610 2/20 0.66
SOAT2 O75908 1/20 0.54

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
SCHEMBL9784440 0.87 SOAT1 (0.81) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL17471275 0.86 PPARG (0.85) PPARGPPARAPPARDSOAT1
SCHEMBL6744450 0.86 PPARG (0.76) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL10587602 0.85 SOAT1 (0.86) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL9257327 0.85 SOAT1 (0.86) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL6747512 0.85 PPARG (0.73) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL9152529 0.84 SOAT1 (0.67) PPARGPPARAPPARDSOAT1SOAT2
Gsk-9578 SCHEMBL68327 0.84 PPARG (1.00) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL8159724 0.84 PPARA (1.00) PPARGPPARAPPARDSOAT1SOAT2
Gsk-9578 SCHEMBL30475595 0.84 PPARG (1.00) PPARGPPARAPPARDSOAT1SOAT2

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
CN-103687856-B A novel 1,2,3,4-tetrahydroquinoline derivative useful for the treatment of diabetes LILLY CO ELI 2015-07-22 CN disclosed