SCHEMBL1123379

SCHEMBL1123379

O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccc(OCc2cccc(OCc3ccccc3)c2)c1

nearest known ligand 0.95

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 15/20 0.95
CMKLR2 P46091 1/20 0.77
CMKLR1 Q99788 1/20 0.77
SMPD1 P17405 1/20 0.63
PTPN1 P18031 2/20 0.62
CYP4F2 P78329 2/20 0.60
CYP4A11 Q02928 2/20 0.60

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
SCHEMBL27638081 0.97 GPR132 (0.89) GPR132CMKLR2CMKLR1PTPN1CYP4F2
SCHEMBL1122680 0.97 GPR132 (0.89) GPR132CMKLR2CMKLR1PTPN1CYP4F2
SCHEMBL1122810 0.94 GPR132 (0.93) GPR132CMKLR2CMKLR1SMPD1PTPN1
SCHEMBL27638045 0.94 GPR132 (0.93) GPR132CMKLR2CMKLR1SMPD1PTPN1
SCHEMBL1123644 0.94 GPR132 (0.93) GPR132CMKLR2CMKLR1SMPD1PTPN1
SCHEMBL1123646 0.94 GPR132 (0.93) GPR132CMKLR2CMKLR1SMPD1PTPN1
SCHEMBL1122807 0.93 GPR132 (0.82) GPR132CMKLR2CMKLR1PTPN1
SCHEMBL1123605 0.91 GPR132 (0.87) GPR132CMKLR2CMKLR1SMPD1PTPN1
SCHEMBL1123316 0.91 GPR132 (0.87) GPR132CMKLR2CMKLR1SMPD1PTPN1
SCHEMBL1122875 0.91 GPR132 (0.79) GPR132CMKLR2CMKLR1PTPN1

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 3 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
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