SCHEMBL4331574

SCHEMBL4331574

CC=CC(=O)OCC(N)CC=C(C)C(=O)O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.30

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
SCHEMBL2504035 0.83 GSTP1 (0.30)
SCHEMBL4336993 0.82
SCHEMBL4331586 0.79
SCHEMBL28018334 0.75 TTR (0.36)
SCHEMBL29412942 0.71 HCAR2 (0.48)
SCHEMBL25259932 0.71 GRIK1 (0.36) GRIK1
SCHEMBL15772329 0.71 GRIK1 (0.35) GRIK1
SCHEMBL6249649 0.71 GRIK1 (0.35) GRIK1
SCHEMBL6249644 0.71 GRIK1 (0.35) GRIK1
SCHEMBL2472765 0.70 TSHR (0.39)

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
US-20090264551-A1 Photocurable fixture for orthopedic surgery background of the invention ALCARE CO., LTD. 2009-10-22 US disclosed