SCHEMBL8564248

SCHEMBL8564248

CC(C)c1ccc(OC(CC(N)C(=O)O)C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.49
GRIK2 Q13002 1/20 0.49
PPARA Q07869 12/20 0.44
PPARG P37231 11/20 0.44
KIF11 P52732 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
SLC7A5 Q01650 1/20 0.42
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41

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
SCHEMBL8564253 1.00 GRIK1 (0.49) GRIK1GRIK2PPARAPPARGKIF11
SCHEMBL8558724 0.84 PPARG (0.55) GRIK1GRIK2PPARAPPARGKIF11
SCHEMBL8560351 0.84 PPARG (0.59) GRIK1GRIK2PPARAPPARGKIF11
SCHEMBL8558721 0.84 PPARG (0.55) GRIK1GRIK2PPARAPPARGKIF11
SCHEMBL8559317 0.84 PPARG (0.55) GRIK1GRIK2PPARAPPARGKIF11
SCHEMBL8559217 0.82 PPARG (0.53) PPARAPPARG
SCHEMBL8559220 0.82 PPARG (0.53) PPARAPPARG
SCHEMBL8935922 0.81 SMN1; SMN2 (0.61) PPARAPPARGSMN1; SMN2RXRARXRB
SCHEMBL4030805 0.81 SMN1; SMN2 (0.61) PPARAPPARGSMN1; SMN2RXRARXRB
SCHEMBL8564512 0.80 PPARG (0.63) GRIK1GRIK2PPARAPPARG

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
US-5843997-A Excitatory amino acid receptor antagonists ELI LILLY AND COMPANY (US) 1998-12-01 US disclosed
US-5576323-A CENTRAL NERVOUS SYSTEM DISORDERS ELI LILLY AND COMPANY (US) 1996-11-19 US disclosed