SCHEMBL31448424

SCHEMBL31448424

O=C(O)CCCCCCOc1ccc(OCCCCCCC(=O)O)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.71
ALB P02768 1/20 0.66
PLA2G4B P0C869 5/20 0.62
L3MBTL1 Q9Y468 1/20 0.60
HDAC1 Q13547 4/20 0.59
HDAC2 Q92769 4/20 0.59
FFAR1 O14842 2/20 0.59
HDAC3 O15379 2/20 0.59
HDAC4 P56524 2/20 0.59
HDAC7 Q8WUI4 2/20 0.59
HDAC10 Q969S8 2/20 0.59
HDAC11 Q96DB2 2/20 0.59
HDAC8 Q9BY41 2/20 0.59
HDAC6 Q9UBN7 2/20 0.59
HDAC9 Q9UKV0 2/20 0.59
HDAC5 Q9UQL6 2/20 0.59
GAA P10253 1/20 0.57

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
SCHEMBL21073528 1.00 PPARA (0.71) PPARAALBPLA2G4BL3MBTL1HDAC1
SCHEMBL29141429 1.00 PPARA (0.71) PPARAALBPLA2G4BL3MBTL1HDAC1
SCHEMBL31448470 0.98 PPARA (0.73) PPARAALBPLA2G4BL3MBTL1HDAC1
SCHEMBL7747968 0.92 ALB (0.68) PPARAALBPLA2G4B
SCHEMBL12534514 0.92 ALB (0.68) PPARAALBPLA2G4B
SCHEMBL2158826 0.92 ALB (0.68) PPARAALBPLA2G4B
SCHEMBL25228768 0.92 PPARA (0.72) PPARAALBHDAC1HDAC2FFAR1
SCHEMBL11616532 0.92 PPARA (0.72) PPARAALBHDAC1HDAC2FFAR1
SCHEMBL557510 0.92 PPARA (0.72) PPARAALBHDAC1HDAC2FFAR1
SCHEMBL503552 0.92 PPARA (0.72) PPARAALBHDAC1HDAC2FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119913356-A Extractant, preparation method and application thereof 浙江大学衢州研究院 2025-05-02 CN claimed
CN-119913356-A Extractant, preparation method and application thereof 浙江大学衢州研究院 2025-05-02 CN disclosed
CN-119913356-A Extractant, preparation method and application thereof 浙江大学衢州研究院 2025-05-02 CN disclosed