SCHEMBL1123055

SCHEMBL1123055

COC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)c1ccc(OCc2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.80
RAB9A P51151 1/20 0.80
PPARG P37231 4/20 0.69
LNPEP Q9UIQ6 2/20 0.65
ERAP2 Q6P179 1/20 0.65
GPR132 Q9UNW8 2/20 0.62
LTA4H P09960 1/20 0.60
PTPN1 P18031 1/20 0.60
YAP1 P46937 3/20 0.59
ALDH1A1 P00352 2/20 0.58
LMNA P02545 2/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
GLA P06280 1/20 0.58
MMP9 P14780 1/20 0.56
MMP8 P22894 1/20 0.56
TSHR P16473 1/20 0.55

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
SCHEMBL1122925 0.96 GAA (0.75) GAARAB9APPARGLNPEPERAP2
SCHEMBL1122834 0.96 GAA (0.75) GAARAB9APPARGLNPEPERAP2
SCHEMBL1123370 0.95 GAA (0.73) GAARAB9APPARGLNPEPERAP2
SCHEMBL6030161 0.95 GAA (0.77) GAARAB9APPARGLNPEPERAP2
SCHEMBL27638047 0.93 RAB9A (0.74) GAARAB9APPARGLNPEPERAP2
SCHEMBL1122610 0.93 RAB9A (0.74) GAARAB9APPARGLNPEPERAP2
SCHEMBL1123147 0.93 GAA (0.71) GAARAB9APPARGLNPEPERAP2
SCHEMBL1123382 0.93 GAA (0.71) GAARAB9APPARGLNPEPERAP2
SCHEMBL1122645 0.92 GAA (0.69) GAARAB9APPARGLNPEPERAP2
SCHEMBL27658965 0.92 GAA (0.69) GAARAB9APPARGLNPEPERAP2

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