SCHEMBL27658917

SCHEMBL27658917

COC(=O)C(Cc1ccc(OCc2ccccc2)cc1)NC(=O)c1ccc(OCc2ccccc2C)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.68
RAB9A P51151 1/20 0.68
PPARG P37231 4/20 0.60
ERAP2 Q6P179 1/20 0.57
LNPEP Q9UIQ6 1/20 0.57
GPR132 Q9UNW8 2/20 0.54
PTPN1 P18031 1/20 0.52
YAP1 P46937 2/20 0.52
LTA4H P09960 1/20 0.52
MAOB P27338 1/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
GLA P06280 1/20 0.50
GABRA5 P31644 1/20 0.49

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
SCHEMBL1122871 1.00 GAA (0.68) GAARAB9APPARGERAP2LNPEP
SCHEMBL1123038 0.92 GAA (0.63) GAARAB9APPARGERAP2LNPEP
SCHEMBL1123708 0.92 GAA (0.63) GAARAB9APPARGERAP2LNPEP
SCHEMBL1123101 0.92 GPR132 (0.64) GAARAB9APPARGGPR132PTPN1
SCHEMBL1122809 0.92 GPR132 (0.64) GAARAB9APPARGGPR132PTPN1
SCHEMBL1123055 0.92 GAA (0.80) GAARAB9APPARGERAP2LNPEP
SCHEMBL1122742 0.89 GAA (0.67) GAARAB9APPARGERAP2LNPEP
SCHEMBL1122544 0.89 RAB9A (0.67) GAARAB9APPARGERAP2LNPEP
SCHEMBL1123095 0.89 GAA (0.67) GAARAB9APPARGERAP2LNPEP
SCHEMBL1123258 0.89 GAA (0.67) GAARAB9APPARGERAP2LNPEP

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
CN-1835914-A New benzamides as PPAR[upsilon] modulators S A L V A T LAB SA (ES) 2006-09-20 CN claimed
CN-1835914-A New benzamides as PPAR[upsilon] modulators S A L V A T LAB SA (ES) 2006-09-20 CN disclosed