SCHEMBL27539628

SCHEMBL27539628

CCCCCCCCCCCC(N)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.53
GRIK2 Q13002 2/20 0.53
GNAI3 P08754 1/20 0.51
GNAO1 P09471 1/20 0.51
GNAI1 P63096 1/20 0.51
LAP3 P28838 2/20 0.50
SLC1A2 P43004 1/20 0.50
SLC1A1 P43005 1/20 0.50
DPP7 Q9UHL4 1/20 0.50
GPR84 Q9NQS5 3/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
SPHK1 Q9NYA1 1/20 0.48
FFAR1 O14842 1/20 0.48
EPHX1 P07099 1/20 0.47
MAPT P10636 1/20 0.47
TP53 P04637 1/20 0.47
LCK P06239 1/20 0.47
PPARD Q03181 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.47

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
SCHEMBL14038058 1.00 GRIK1 (0.53) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL8192972 1.00 GRIK1 (0.53) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL27569923 1.00 GRIK1 (0.53) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL2920941 1.00 GRIK1 (0.53) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL6762998 1.00 GRIK1 (0.53) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL28888696 1.00 GRIK1 (0.53) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL8425258 1.00 GRIK1 (0.53) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL18151772 1.00 GRIK1 (0.53) GRIK1GRIK2GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL27438801 0.98 GRIK1 (0.52) GRIK1GRIK2GNAI3GNAO1GNAI1
Ammonia Solution, Strong SCHEMBL8469689 0.98 GRIK1 (0.52) GRIK1GRIK2GNAI3GNAO1GNAI1

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
CN-1109559-C Stents with radioactive surface coating, its preparing method and use for preventing renarrow SCHERING AG (DE) 2003-05-28 CN disclosed