SCHEMBL2823784

SCHEMBL2823784

CCCCCCC(O)C/C=C/CCCCCCCC(=O)OC

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.72
FFAR4 Q5NUL3 1/20 0.72
FAAH O00519 2/20 0.67
EPHX2 P34913 1/20 0.57
DGKA P23743 1/20 0.56
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
TRPV1 Q8NER1 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.51
LPAR1 Q92633 5/20 0.50
ENPP2 Q13822 2/20 0.50
LPAR4 Q99677 2/20 0.50
LPAR5 Q9H1C0 2/20 0.50
LPAR2 Q9HBW0 2/20 0.50
LPAR3 Q9UBY5 2/20 0.50
CNR2 P34972 1/20 0.50
CES2 O00748 1/20 0.50
LPAR6 P43657 1/20 0.50
PPARG P37231 1/20 0.49

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
SCHEMBL8626686 1.00 FFAR1 (0.72) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL445374 1.00 FFAR1 (0.72) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL8945069 1.00 FFAR1 (0.72) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL1594097 1.00 FFAR1 (0.72) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL868137 1.00 FFAR1 (0.72) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL25392604 1.00 FFAR1 (0.72) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL18823716 1.00 FFAR1 (0.72) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL290360 1.00 FFAR1 (0.72) FFAR1FFAR4FAAHEPHX2DGKA
Ammonia Solution, Strong SCHEMBL28681002 0.99 FFAR1 (0.71) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL2788738 0.99 FFAR1 (0.71) FFAR1FFAR4FAAHEPHX2DGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2475637-B1 NOVEL CASTOR OIL DERIVATIVES AND METHOD FOR THE PRODUCTION THEREOF CENTRE NAT RECH SCIENT (FR) 2019-07-24 EP disclosed
US-9029494-B2 Castor oil derivatives and method for the production thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2015-05-12 US disclosed
US-9029494-B2 Castor oil derivatives and method for the production thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2015-05-12 US disclosed
US-20130005936-A1 NOVEL CASTOR OIL DERIVATIVES AND METHOD FOR THE PRODUCTION THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2013-01-03 US disclosed
US-20130005936-A1 NOVEL CASTOR OIL DERIVATIVES AND METHOD FOR THE PRODUCTION THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2013-01-03 US disclosed
WO-2011030075-A1 NOVEL CASTOR OIL DERIVATIVES AND METHOD FOR THE PRODUCTION THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2011-03-17 WO disclosed
EP-2242361-A2 USE OF SURFACTANTS FOR MITIGATING DAMAGE TO PLANTS FROM PESTS Bjarn, Llc (US) 2010-10-27 EP disclosed
EP-2242369-A1 USE OF BIO-DERIVED SURFACTANTS FOR MITIGATING DAMAGE TO PLANTS FROM PESTS Bjarn, Llc (US) 2010-10-27 EP disclosed
WO-2009091572-A2 USE OF SURFACTANTS FOR MITIGATING DAMAGE TO PLANTS FROM PESTS BJARN, LLC (US) 2009-07-23 WO disclosed
WO-2009091564-A1 USE OF BIO-DERIVED SURFACTANTS FOR MITIGATING DAMAGE TO PLANTS FROM PESTS BJARN, LLC (US) 2009-07-23 WO disclosed
US-20090186761-A1 Use of bio-derived surfactants for mitigating damage to plants from pests CLEARESO, LLC 2009-07-23 US disclosed
US-20090186767-A1 Use of surfactants for mitigating damage to plants from pests CLEARESO, LLC 2009-07-23 US disclosed
EP-1673328-B1 AN IMPROVED PROCESS FOR THE SYNTHESIS OF UNSATURATED ALCOHOLS DOW GLOBAL TECHNOLOGIES INC (US) 2008-07-09 EP disclosed
US-7176336-B2 Preparing 9-octadecene-7,12-diol by catalyzing methyl ricinoleate derived from a seed oil, in presence of a metathesis catalyst; improved yield; use in manufacture of surfactants and thermoplastic polyurethanes DOW GLOBAL TECHNOLOGIES INC. (US) 2007-02-13 US disclosed
EP-1673328-A2 AN IMPROVED PROCESS FOR THE SYNTHESIS OF UNSATURATED ALCOHOLS Dow Global Technologies Inc. (US) 2006-06-28 EP disclosed
US-6903052-B2 Nematicidal compositions and methods DIVERGENCE, INC. (US) 2005-06-07 US disclosed
WO-2005040077-A2 AN IMPROVED PROCESS FOR THE SYNTHESIS OF UNSATURATED ALCOHOLS DOW GLOBAL TECHNOLOGIES INC. (US) 2005-05-06 WO disclosed
US-20050080301-A1 Process for the synthesis of unsaturated alcohols DOW GLOBAL TECHNOLOGIES LLC 2005-04-14 US disclosed
US-20030176402-A1 Nematicidal compositions and methods MONSANTO TECHNOLOGY LLC 2003-09-18 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 (5 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-20050080301-A1 Process for the synthesis of unsaturated alcohols FASN, SQLE, ALOX12 FFAR1 119/4885FFAR4 189/4885FAAH 181/4885
US-20090186767-A1 Use of surfactants for mitigating damage to plants from pests FAAH, SGMS2, FASN FFAR1 194/4885FFAR4 601/4885FAAH 1/4885
US-20090186761-A1 Use of bio-derived surfactants for mitigating damage to plants from pests SGMS2, SGMS1, PHOSPHO1 FFAR1 760/4885FFAR4 1749/4885FAAH 21/4885
US-20030176402-A1 Nematicidal compositions and methods FADS2, FASN, SCD FFAR1 226/4885FFAR4 270/4885FAAH 9/4885
US-20130005936-A1 NOVEL CASTOR OIL DERIVATIVES AND METHOD FOR THE PRODUCTION THEREOF CYP46A1, CYP17A1, CYP4A11 FFAR1 243/4885FFAR4 495/4885FAAH 1238/4885

“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.