Dodecanoate

Dodecanoate

SCHEMBL5024159

CCCCCCCCCCCC(=O)O.O=C(O)CS

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.81
PPARG P37231 7/20 0.81
PPARD Q03181 7/20 0.81
PPARA Q07869 7/20 0.81
HDAC11 Q96DB2 5/20 0.81
TSHR P16473 4/20 0.81
PTPN1 P18031 3/20 0.81
FABP4 P15090 3/20 0.81
ALDH1A1 P00352 2/20 0.81
TLR2 O60603 2/20 0.81
TDP1 Q9NUW8 2/20 0.81
KMT2A Q03164 2/20 0.81
ALOX15 P16050 2/20 0.81
HSD17B10 Q99714 2/20 0.81
SLC22A6 Q4U2R8 1/20 0.81
SLC22A8 Q8TCC7 1/20 0.81
MEN1 O00255 1/20 0.81
ESR1 P03372 1/20 0.81
PDE4A P27815 1/20 0.81
PDE3A Q14432 1/20 0.81

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 SCHEMBL11661839 1.00 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL10793856 1.00 GPR84 (0.81) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL9567283 0.93 GPR84 (0.85) GPR84PPARGPPARDPPARAHDAC11
Lignoceric Acid SCHEMBL23751106 0.90 GPR84 (1.00) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL25287435 0.90 GPR84 (1.00) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL25290273 0.90 GPR84 (1.00) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL25293218 0.90 GPR84 (1.00) GPR84PPARGPPARDPPARAHDAC11
Myristic Acid SCHEMBL25290278 0.90 GPR84 (1.00) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL23649545 0.90 GPR84 (1.00) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL25295592 0.90 GPR84 (1.00) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107446111-B Silane terminated resin containing carbamate group and preparation method thereof 万华化学集团股份有限公司 2020-06-02 CN disclosed
EP-1015470-A4 COMPOSITION AND METHOD FOR DELIVERY OF NUCLEIC ACIDS COMMW SCIENT IND RES ORG (AU) 2008-05-07 EP disclosed
EP-1015470-A1 COMPOSITION AND METHOD FOR DELIVERY OF NUCLEIC ACIDS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2000-07-05 EP disclosed
WO-1997025339-A1 COMPOSITION AND METHOD FOR DELIVERY OF NUCLEIC ACIDS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1997-07-17 WO disclosed