SCHEMBL5720741

SCHEMBL5720741

Cc1cccc(C)c1OCCOc1cccc(C(=O)N[C@@H](Cc2ccc(OCc3ccccc3)cc2)C(=O)O)c1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 13/20 0.74
CMKLR2 P46091 1/20 0.62
CMKLR1 Q99788 1/20 0.62
PTPN1 P18031 2/20 0.58
GPR34 Q9UPC5 2/20 0.56
PPARG P37231 2/20 0.55
ITGB3 P05106 1/20 0.54
ITGA2B P08514 1/20 0.54

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
SCHEMBL1122773 0.93 GPR132 (0.63) GPR132CMKLR2CMKLR1PTPN1GPR34
SCHEMBL27638045 0.89 GPR132 (0.93) GPR132CMKLR2CMKLR1PTPN1GPR34
SCHEMBL1122810 0.89 GPR132 (0.93) GPR132CMKLR2CMKLR1PTPN1GPR34
SCHEMBL1123644 0.89 GPR132 (0.93) GPR132CMKLR2CMKLR1PTPN1GPR34
SCHEMBL1123646 0.89 GPR132 (0.93) GPR132CMKLR2CMKLR1PTPN1GPR34
SCHEMBL27638081 0.87 GPR132 (0.89) GPR132CMKLR2CMKLR1PTPN1GPR34
SCHEMBL1122680 0.87 GPR132 (0.89) GPR132CMKLR2CMKLR1PTPN1GPR34
SCHEMBL27638093 0.87 GPR132 (0.80) GPR132CMKLR2CMKLR1PTPN1GPR34
SCHEMBL1123130 0.87 GPR132 (0.80) GPR132CMKLR2CMKLR1PTPN1GPR34
SCHEMBL1123605 0.86 GPR132 (0.87) GPR132CMKLR2CMKLR1PTPN1GPR34

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-A2 NEW BENZAMIDES AS PPATY MODULATORS LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2006-04-12 EP disclosed
WO-2004110983-A2 NEW BENZAMIDES AS PPARϒ MODULATORS LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2004-12-23 WO disclosed