SCHEMBL8559217

SCHEMBL8559217

NC(CC(Oc1ccccc1)C(=O)O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.53
PPARA Q07869 16/20 0.53
SLC1A3 P43003 1/20 0.49
SLC1A2 P43004 1/20 0.49
SLC1A1 P43005 1/20 0.49
GRM2 Q14416 1/20 0.49
GRM3 Q14832 1/20 0.49

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
SCHEMBL8559220 1.00 PPARG (0.53) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL8561508 0.94 PPARG (0.63) PPARGPPARA
SCHEMBL8561497 0.94 PPARG (0.63) PPARGPPARA
SCHEMBL8559845 0.90 PPARG (0.63) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL8564512 0.90 PPARG (0.63) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL8559849 0.90 PPARG (0.63) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL8561366 0.88 PPARG (0.49) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL8595655 0.88 PPARG (0.68) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL8562657 0.88 PPARG (0.68) PPARGPPARA
SCHEMBL8562648 0.88 PPARG (0.68) PPARGPPARA

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