Dodecanoate

Dodecanoate

SCHEMBL1661355

CCCCCCCCCCCC(=O)[O-].CCc1[nH]cc[n+]1C

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 7/20 0.44
CA1 P00915 1/20 0.41
CES2 O00748 3/20 0.38
CES1 P23141 3/20 0.38
NFKB1 P19838 1/20 0.36
PPARG P37231 1/20 0.36

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
Octanoic Acid SCHEMBL1661625 1.00 FABP3 (0.44) FABP3CA1CES2CES1NFKB1
Undecanoate SCHEMBL1661242 1.00 FABP3 (0.44) FABP3CA1CES2CES1NFKB1
Heptanoate SCHEMBL1664015 1.00 FABP3 (0.44) FABP3CA1CES2CES1NFKB1
Nonanoate SCHEMBL1666129 1.00 FABP3 (0.44) FABP3CA1CES2CES1NFKB1
Decanoic Acid SCHEMBL1661626 1.00 FABP3 (0.44) FABP3CA1CES2CES1NFKB1
Dodecanoate SCHEMBL1663407 0.87 SMN1; SMN2 (0.41) FABP3CA1
Decanoic Acid SCHEMBL1663010 0.84 GPR84 (0.35) FABP3PPARG
Octanoic Acid SCHEMBL1663417 0.84 FABP3 (0.43) FABP3CA1CES2CES1NFKB1
Propionic Acid SCHEMBL528119 0.83
Beta-Alanine SCHEMBL16345992 0.82 FFAR3 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486175-A2 A PROCESS OF MANUFACTURING LOW FIBRILLATING CELLULOSE FIBERS Grasim Industries Limited (IN) 2012-08-15 EP claimed
EP-2486062-A2 A PROCESS OF MANUFACTURING LOW-FIBRILLATING CELLULOSIC FIBERS Grasim Industries Limited (IN) 2012-08-15 EP claimed
WO-2011048608-A2 A PROCESS OF MANUFACTURING LOW-FIBRILLATING CELLULOSIC FIBERS GRASIM INDUSTRIES LIMITED (IN) 2011-04-28 WO claimed
WO-2011048609-A2 A PROCESS OF MANUFACTURING LOW FIBRILLATING CELLULOSE FIBERS GRASIM INDUSTRIES LIMITED (IN) 2011-04-28 WO claimed
EP-2486062-A2 A PROCESS OF MANUFACTURING LOW-FIBRILLATING CELLULOSIC FIBERS Grasim Industries Limited (IN) 2012-08-15 EP disclosed
WO-2011048608-A2 A PROCESS OF MANUFACTURING LOW-FIBRILLATING CELLULOSIC FIBERS GRASIM INDUSTRIES LIMITED (IN) 2011-04-28 WO disclosed