Nonanoate

Nonanoate

SCHEMBL6153130

CC(C)[O-].CC(C)[O-].CCCCCCCCC(=O)[O-].[Al+3]

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 7/20 0.62
CA1 P00915 1/20 0.60
CES2 O00748 4/20 0.56
CES1 P23141 4/20 0.56
NFKB1 P19838 1/20 0.55
GPR84 Q9NQS5 1/20 0.53

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
Arachidic Acid SCHEMBL28953539 1.00 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Decanoic Acid SCHEMBL6153196 1.00 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL1228588 1.00 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Palmitic Acid SCHEMBL8803956 1.00 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Octanoic Acid SCHEMBL6153026 1.00 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL9855948 1.00 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Hexanoate SCHEMBL1230471 0.98 CA1 (0.62) FABP3CA1CES2CES1NFKB1
Heptanoate SCHEMBL7723609 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL1230619 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL31364148 0.96 FABP3 (0.62) FABP3CA1CES2CES1NFKB1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1038669-B1 Method of producing directly imageable waterless planographic printing plate TORAY INDUSTRIES (JP) 2005-01-26 EP disclosed
US-6284433-B1 IMAGEWISELY IRRADIATING PRECURSOR OF PRINTING PLATE WITH LASER BEAM, PRE-TREATING PRECURSOR WITH GLYCOL COMPOUND AND/OR A GLYCOL ETHER COMPOUND; REMOVING INK REPELLENT LAYER WHEREIN HEAT SENSITIVE LAYER IS PARTIALLY LEFT ON PRINTING PLATE TORAY INDUSTRIES, INC. (JP) 2001-09-04 US disclosed
EP-1038669-A1 Method of producing directly imageable waterless planographic printing plate TORAY INDUSTRIES, INC. (JP) 2000-09-27 EP disclosed