SCHEMBL4027014

SCHEMBL4027014

CC(C)N(Cc1ccccc1)C(=O)N1CCC[C@@H](c2cccc(OC(C)(C)C(=O)O)c2)C1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.65
BCL9 O00512 19/20 0.63
CTNNB1 P35222 19/20 0.63

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
SCHEMBL4027017 1.00 PPARA (0.65) PPARABCL9CTNNB1
SCHEMBL4026251 0.84 PPARA (0.69) PPARABCL9CTNNB1
SCHEMBL4027855 0.83 PPARA (0.83) PPARABCL9CTNNB1
SCHEMBL4033301 0.82 PPARA (0.75) PPARABCL9CTNNB1
SCHEMBL4030427 0.81 BCL9 (0.88) PPARABCL9CTNNB1
SCHEMBL4030421 0.81 BCL9 (0.88) PPARABCL9CTNNB1
SCHEMBL4034083 0.81 PPARA (0.69) PPARABCL9CTNNB1
SCHEMBL5504524 0.81 BCL9 (0.71) PPARABCL9CTNNB1
SCHEMBL5499849 0.81 BCL9 (0.71) PPARABCL9CTNNB1
SCHEMBL4029621 0.80 BCL9 (0.70) PPARABCL9CTNNB1

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-1567493-B1 PHENYL SUBSTITUTED PIPERIDINE COMPOUNDS FOR USE AS PPAR ACTIVATORS PFIZER PROD INC (US) 2009-03-18 EP claimed