SCHEMBL1122788

SCHEMBL1122788

O=C(NC(Cc1ccc(OCc2ccccc2)cc1)C(=O)O)c1ccc(OCC(=O)N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 3/20 0.62
GPR34 Q9UPC5 7/20 0.59
PTPN1 P18031 4/20 0.58
PPARG P37231 3/20 0.54
GAA P10253 1/20 0.53
RAB9A P51151 1/20 0.53
ITGB3 P05106 1/20 0.53
ITGA2B P08514 1/20 0.53

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
SCHEMBL5936629 0.91 PTPN1 (0.58) GPR132GPR34PTPN1PPARGGAA
SCHEMBL1123459 0.91 GAA (0.67) GPR132GPR34PTPN1PPARGGAA
SCHEMBL1123300 0.91 GPR132 (0.59) GPR132GPR34PTPN1PPARG
SCHEMBL1123310 0.89 PTPN1 (0.61) GPR132GPR34PTPN1PPARGGAA
SCHEMBL1123232 0.88 GPR132 (0.77) GPR132GPR34PTPN1PPARGGAA
SCHEMBL27658914 0.88 GPR132 (0.77) GPR132GPR34PTPN1PPARGGAA
SCHEMBL1123299 0.88 GPR132 (0.77) GPR132GPR34PTPN1PPARGGAA
SCHEMBL1123033 0.88 GPR132 (0.77) GPR132GPR34PTPN1PPARGGAA
SCHEMBL1123267 0.88 GPR132 (0.62) GPR132GPR34PTPN1PPARGGAA
SCHEMBL1122757 0.87 GPR132 (0.78) GPR132GPR34PTPN1PPARGGAA

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 1 patent. 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