SCHEMBL1123392

SCHEMBL1123392

O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1cccc(OCc2cccc(OCc3ccccc3)c2)c1

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 15/20 0.78
CMKLR2 P46091 1/20 0.56
CMKLR1 Q99788 1/20 0.56
SMPD1 P17405 1/20 0.54
GRN P28799 1/20 0.53
SORT1 Q99523 1/20 0.53
CTSL P07711 2/20 0.51
CTSS P25774 2/20 0.51
CTSB P07858 1/20 0.51
CTSK P43235 1/20 0.51

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
SCHEMBL1123119 0.95 GPR132 (0.77) GPR132CMKLR2CMKLR1SMPD1GRN
SCHEMBL1123390 0.93 GPR132 (0.68) GPR132CMKLR2CMKLR1GRNSORT1
SCHEMBL1122740 0.91 GPR132 (0.66) GPR132CMKLR2CMKLR1SMPD1CTSL
SCHEMBL1123259 0.87 GPR132 (0.68) GPR132CMKLR2CMKLR1SMPD1GRN
SCHEMBL1123253 0.87 GPR132 (0.65) GPR132CMKLR2CMKLR1SMPD1CTSL
SCHEMBL1123574 0.85 GPR132 (0.58) GPR132CTSLCTSSCTSBCTSK
SCHEMBL1123575 0.85 GPR132 (0.58) GPR132CTSLCTSSCTSBCTSK
SCHEMBL18114408 0.83 GPR132 (0.65) GPR132GRNSORT1CTSLCTSS
SCHEMBL1123379 0.83 GPR132 (0.95) GPR132CMKLR2CMKLR1SMPD1
SCHEMBL1122784 0.82 GPR132 (0.62) GPR132GRNSORT1CTSLCTSS

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