SCHEMBL7834780

SCHEMBL7834780

O=C(O)CCCC/C(=N\OCc1ccc(O)cc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.53
PPARG P37231 12/20 0.48
TBXA2R P21731 6/20 0.46
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
TBXAS1 P24557 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
SCHEMBL7834782 1.00 PPARA (0.53) PPARAPPARGTBXA2RHDAC3HDAC4
SCHEMBL7837126 0.99 PPARA (0.52) PPARAPPARGTBXA2RHDAC3HDAC4
SCHEMBL7837124 0.99 PPARA (0.52) PPARAPPARGTBXA2RHDAC3HDAC4
SCHEMBL6158746 0.85 TBXAS1 (0.49) PPARAPPARGTBXAS1
SCHEMBL6158748 0.85 TBXAS1 (0.49) PPARAPPARGTBXAS1
SCHEMBL6158752 0.85 TBXAS1 (0.49) PPARAPPARGTBXAS1
SCHEMBL6160170 0.84 TBXAS1 (0.48) PPARAPPARGTBXAS1
SCHEMBL6160171 0.84 TBXAS1 (0.48) PPARAPPARGTBXAS1
SCHEMBL6160162 0.84 TBXAS1 (0.48) PPARAPPARGTBXAS1
SCHEMBL2047385 0.82 PPARA (0.46) PPARAPPARG

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-1077957-A1 OXYIMINOALKANOIC ACID DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Chemical Industries, Ltd. (JP) 2001-02-28 EP disclosed
WO-1999058510-A1 OXYIMINOALKANOIC ACID DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-18 WO disclosed