SCHEMBL3285291

SCHEMBL3285291

CCCCCCCCC(COCC(CCCCCCCC)C(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.58
GRIK2 Q13002 2/20 0.58
CA2 P00918 2/20 0.55
MAPK1 P28482 1/20 0.55
SLC1A2 P43004 2/20 0.55
SLC1A1 P43005 2/20 0.55
GPR84 Q9NQS5 7/20 0.53
FFAR1 O14842 1/20 0.53
MAPT P10636 1/20 0.52
LCK P06239 1/20 0.52
PPARD Q03181 1/20 0.52
ZDHHC20 Q5W0Z9 1/20 0.52
ZDHHC2 Q9UIJ5 1/20 0.52
ACE2 Q9BYF1 1/20 0.48
SLC1A3 P43003 1/20 0.47
CHRM1 P11229 1/20 0.46
AKR1A1 P14550 1/20 0.46
CHRM3 P20309 1/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46

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
SCHEMBL3280839 1.00 GRIK1 (0.58) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL9335547 0.92 GRIK1 (0.54) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL9423046 0.92 CA2 (0.65) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL2357289 0.90 CA2 (0.53) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25295689 0.85 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25292674 0.85 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25293689 0.85 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25295583 0.85 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25286597 0.85 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL25293243 0.85 GRIK1 (0.68) GRIK1GRIK2CA2MAPK1SLC1A2

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-7704939-B2 Surfactant SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2010-04-27 US disclosed
US-20070167343-A1 neutralized salt including alkylbenzenesulphonates (toluenesulfonic acid guanidine salt, toluenesulfonic acid DBU salt, toluenesulfonic acid DBN salt) for cleaning electonics SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2007-07-19 US disclosed