Dodecanoate

Dodecanoate

SCHEMBL599337

CCCCCCCCCCCC(=O)O.NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.65
PKM P14618 1/20 0.65
PTGS1 P23219 1/20 0.65
XIAP P98170 1/20 0.65
SLC7A5 Q01650 1/20 0.65
LTA4H P09960 1/20 0.61
SLC15A1 P46059 1/20 0.56
CSNK1E P49674 1/20 0.51
GPR84 Q9NQS5 7/20 0.50
PPARG P37231 7/20 0.50
PPARD Q03181 7/20 0.50
PPARA Q07869 7/20 0.50
HDAC11 Q96DB2 5/20 0.50
TSHR P16473 4/20 0.50
PTPN1 P18031 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TLR2 O60603 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
FABP4 P15090 2/20 0.50
SLC22A6 Q4U2R8 1/20 0.50

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
Dl-Phenylalanine SCHEMBL598090 1.00 ALPI (0.65) ALPIPKMPTGS1XIAPSLC7A5
Dodecanoate SCHEMBL599338 1.00 ALPI (0.65) ALPIPKMPTGS1XIAPSLC7A5
Decanoic Acid SCHEMBL17667545 1.00 ALPI (0.65) ALPIPKMPTGS1XIAPSLC7A5
Phenylalanine SCHEMBL598091 1.00 ALPI (0.65) ALPIPKMPTGS1XIAPSLC7A5
Tetradecane SCHEMBL21002171 0.92 SLC7A5 (0.76) ALPIPKMPTGS1XIAPSLC7A5
Dl-Phenylalanine SCHEMBL15656237 0.91 SLC7A5 (0.79) ALPIPKMPTGS1XIAPSLC7A5
Phenylalanine SCHEMBL15656236 0.91 SLC7A5 (0.79) ALPIPKMPTGS1XIAPSLC7A5
Dodecanoate SCHEMBL2779341 0.90 ALPI (0.52) ALPIPKMPTGS1XIAPSLC7A5
Tyrosine SCHEMBL5605357 0.89 SLC7A5 (0.67) ALPIPKMPTGS1XIAPSLC7A5
Stearic Acid SCHEMBL4276901 0.89 SLC7A5 (0.67) ALPIPKMPTGS1XIAPSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948199-B1 PHARMACEUTICAL COMPOSITIONS FOR THE ADMINISTRATION OF APTAMERS IDEXX LAB INC (US) 2015-08-12 EP disclosed
EP-1960415-B1 Phospholipid gel compositions for delivery of aptamers and methods of treating conditions using same IDEXX LAB INC (US) 2015-03-04 EP disclosed
US-8293253-B2 Compositions for controlled delivery of pharmaceutically active compounds IDEXX LABORATORIES, INC. (US) 2012-10-23 US disclosed
US-8114440-B2 Pharmaceutical compositions for the administration of aptamers IDEXX LABORATORIES INC. (US) 2012-02-14 US disclosed
US-8017159-B2 Phospholipid gel compositions for delivery of aptamers and methods of treating conditions using same IDEXX LABORATORIES, INC. (US) 2011-09-13 US disclosed
US-20100240741-A1 PHARMACEUTICAL COMPOSITIONS FOR THE ADMINISTRATION OF APTAMERS IDEXX LABORATORIES, INC. (US) 2010-09-23 US disclosed
US-20100204303-A1 Pharmaceutical Compositions for Administering Oligonucleotides IDEXX LABORATORIES, INC. (US) 2010-08-12 US disclosed
US-7754679-B2 Pharmaceutical compositions for the administration of aptamers IDEXX LABORATORIES, INC. (US) 2010-07-13 US disclosed
EP-2197454-A1 PHARMACEUTICAL COMPOSITIONS FOR ADMINISTERING OLIGONUCLEOTIDES IDEXX Laboratories Inc (US) 2010-06-23 EP disclosed
WO-2009042625-A1 PHARMACEUTICAL COMPOSITIONS FOR ADMINISTERING OLIGONUCLEOTIDES IDEXX LABORATORIES, INC. (US) 2009-04-02 WO disclosed
EP-1960415-A2 PHOSPHOLIPID GEL COMPOSITIONS FOR DELIVERY OF APTAMERS AND METHODS OF TREATING CONDITIONS USING SAME IDEXX Laboratories Inc (US) 2008-08-27 EP disclosed
EP-1948199-A1 PHARMACEUTICAL COMPOSITIONS FOR THE ADMINISTRATION OF APTAMERS IDEXX Laboratories Inc (US) 2008-07-30 EP disclosed
EP-1804771-A2 COMPOSITIONS FOR CONTROLLED DELIVERY OF PHARMACEUTICALLY ACTIVE COMPOUNDS IDEXX LABORATORIES, INC. (US) 2007-07-11 EP disclosed
WO-2007058800-A2 PHOSPHOLIPID GEL COMPOSITIONS FOR DELIVERY OF APTAMERS AND METHODS OF TREATING CONDITIONS USING SAME IDEXX LABORATORIES INC. (US) 2007-05-24 WO disclosed
WO-2007058801-A1 PHARMACEUTICAL COMPOSITIONS FOR THE ADMINISTRATION OF APTAMERS IDEXX LABORATORIES INC. (US) 2007-05-24 WO disclosed
US-20070110827-A1 Pharmaceutical compositions for the administration of aptamers IDEXX LABORATORIES INC. 2007-05-17 US disclosed
US-20070110775-A1 Phospholipid gel compositions for delivery of aptamers and methods of treating conditions using same IDEXX LABORATORIES INC. 2007-05-17 US disclosed
US-20070111969-A1 Pharmaceutical compositions for the administration of aptamers IDEXX LABORATORIES INC. 2007-05-17 US disclosed
WO-2006050002-A2 COMPOSITIONS FOR CONTROLLED DELIVERY OF PHARMACEUTICALLY ACTIVE COMPOUNDS IDEXX LABORATORIES, INC. (US) 2006-05-11 WO disclosed
US-20060093632-A1 Compositions for controlled delivery of pharmaceutically active compounds IDEXX LABORATORIES, INC. 2006-05-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060093632-A1 Compositions for controlled delivery of pharmaceutically active compounds LIPA, CEL, LPXN ALPI 194/4885PKM 1626/4885PTGS1 313/4885
US-20100240741-A1 PHARMACEUTICAL COMPOSITIONS FOR THE ADMINISTRATION OF APTAMERS PHOSPHO1, SGMS1, PCYT1A ALPI 1073/4885PKM 2112/4885PTGS1 4398/4885
US-20070111969-A1 Pharmaceutical compositions for the administration of aptamers PHOSPHO1, SGMS1, PCYT1A ALPI 1073/4885PKM 2112/4885PTGS1 4398/4885
US-20100204303-A1 Pharmaceutical Compositions for Administering Oligonucleotides SLCO2A1, SLCO1A2, SLCO2B1 ALPI 439/4885PKM 4011/4885PTGS1 3986/4885
US-20070110827-A1 Pharmaceutical compositions for the administration of aptamers PHOSPHO1, SGMS1, PCYT1A ALPI 1073/4885PKM 2112/4885PTGS1 4398/4885
US-20070110775-A1 Phospholipid gel compositions for delivery of aptamers and methods of treating conditions using same ANXA6, ANXA2, PLTP ALPI 1143/4885PKM 2803/4885PTGS1 1276/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.