SCHEMBL1122963

SCHEMBL1122963

O=C(O)CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)c1ccc(OCc2cccc(OCc3ccccc3)c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.65
FFAR4 Q5NUL3 3/20 0.56
SLC2A1 P11166 4/20 0.55
SLC2A4 P14672 1/20 0.55
PTGES O14684 3/20 0.55
ALOX5 P09917 3/20 0.52
TSHR P16473 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
AKR1B1 P15121 1/20 0.51
LPAR1 Q92633 1/20 0.51
LPAR5 Q9H1C0 1/20 0.51
LTC4S Q16873 1/20 0.51
KMT2A Q03164 1/20 0.50

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
SCHEMBL1123113 0.97 FFAR1 (0.62) FFAR1FFAR4SLC2A1SLC2A4PTGES
SCHEMBL1123559 0.96 FFAR1 (0.62) FFAR1FFAR4SLC2A1SLC2A4PTGES
SCHEMBL1122854 0.95 FFAR1 (0.60) FFAR1FFAR4SLC2A1SLC2A4PTGES
SCHEMBL1123260 0.92 FFAR1 (0.60) FFAR1FFAR4SLC2A1SLC2A4PTGES
SCHEMBL1122984 0.90 NR4A2 (0.56) FFAR1SLC2A1SLC2A4PTGESALOX5
SCHEMBL1122949 0.90 FFAR1 (0.52) FFAR1SLC2A1SLC2A4PTGESALOX5
SCHEMBL1122608 0.89 FFAR1 (0.59) FFAR1FFAR4SLC2A1PTGESALOX5
SCHEMBL1123188 0.87 SLC2A1 (0.52) FFAR1SLC2A1SLC2A4PTGESSMN1; SMN2
SCHEMBL1123394 0.87 KMT2A (0.52) FFAR1FFAR4PTGESTSHRKMT2A
SCHEMBL1123468 0.85 KMT2A (0.54) FFAR1SLC2A1SLC2A4PTGESTSHR

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-1644321-B1 NEW BENZAMIDES AS PPATY MODULATORS S A L V A T LAB SA (ES) 2011-02-09 EP disclosed
CN-1835914-A New benzamides as PPAR[upsilon] modulators S A L V A T LAB SA (ES) 2006-09-20 CN disclosed