Decanoic Acid

Decanoic Acid

SCHEMBL5551402

CCCCCCCCCC(=O)O.NCCCCNCCCO

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.53
PPARG P37231 7/20 0.53
PPARD Q03181 7/20 0.53
PPARA Q07869 7/20 0.53
HDAC11 Q96DB2 5/20 0.53
TSHR P16473 4/20 0.53
ALDH1A1 P00352 3/20 0.53
PTPN1 P18031 3/20 0.53
KMT2A Q03164 3/20 0.53
TLR2 O60603 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
MEN1 O00255 2/20 0.53
FABP4 P15090 2/20 0.53
ALOX15 P16050 2/20 0.53
SLC22A6 Q4U2R8 1/20 0.53
SLC22A8 Q8TCC7 1/20 0.53
ESR1 P03372 1/20 0.53
PDE4A P27815 1/20 0.53
PDE3A Q14432 1/20 0.53
HSD17B10 Q99714 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
Heptanoate SCHEMBL5552606 1.00 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Nonanoate SCHEMBL5551089 1.00 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Undecanoate SCHEMBL5549624 1.00 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL5551524 1.00 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL5551415 1.00 GPR84 (0.53) GPR84PPARGPPARDPPARAHDAC11
Hexanoate SCHEMBL5547209 0.98 AKR1B1 (0.52) GPR84PPARGPPARDPPARAHDAC11
Valeric Acid SCHEMBL5551421 0.94 CYP2D6 (0.48) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL9249058 0.94 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL29747007 0.92 PAOX (0.61) GPR84PPARGPPARDPPARAHDAC11
Hexacosanoic Acid SCHEMBL30380127 0.90 PAOX (0.62) GPR84PPARGPPARDPPARAHDAC11

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-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US claimed