SCHEMBL8623630

SCHEMBL8623630

CCCCCCCCCC(=O)NC(CCCC)C(=O)OS(=O)(=O)C1=CC=CCC1=O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 10/20 0.41
KMT2A Q03164 3/20 0.38
PLA2G2C Q5R387 1/20 0.36
MEN1 O00255 1/20 0.36
FAAH O00519 1/20 0.36
MAPK1 P28482 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
SLC6A5 Q9Y345 1/20 0.35

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
SCHEMBL1401706 0.79 DGKA (0.37) KMT2A
SCHEMBL3249448 0.79 DGKA (0.37) KMT2A
SCHEMBL2162032 0.79 DGKA (0.37) KMT2A
SCHEMBL8333753 0.78 DGKA (0.35) KMT2A
SCHEMBL8069041 0.77 NOD1 (0.47) NOD1KMT2APLA2G2CMEN1FAAH
SCHEMBL427665 0.77 ALDH1A1 (0.43) FAAHSLC6A5
SCHEMBL38842 0.77 ALDH1A1 (0.43) FAAHSLC6A5
SCHEMBL735670 0.77 ALDH1A1 (0.43) FAAHSLC6A5
SCHEMBL7595507 0.75 CA2 (0.35) KMT2A
SCHEMBL8517201 0.75 CA2 (0.35) KMT2A

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-5837670-A AQUEOUS WASH LIQUOR COMPRISING ALKYL SULFATE SURFACTANT, SULFONATED PHTHALOCYANINE, AMIDE SUDS SUPPRESSOR PROCTER & GAMBLE COMPANY, THE 1998-11-17 US disclosed