SCHEMBL3746246

SCHEMBL3746246

CCC1OC1CC1OC1CC1OC1CCCCCCCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.44
PPARG P37231 7/20 0.44
PPARD Q03181 7/20 0.44
PPARA Q07869 7/20 0.44
HDAC11 Q96DB2 5/20 0.44
TSHR P16473 5/20 0.44
PTPN1 P18031 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TLR2 O60603 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
FABP4 P15090 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
MEN1 O00255 1/20 0.44
ESR1 P03372 1/20 0.44
ALOX15 P16050 1/20 0.44
PDE4A P27815 1/20 0.44
KMT2A Q03164 1/20 0.44
PDE3A Q14432 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL11538646 0.95 GPR84 (0.48) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL2482201 0.95 GPR84 (0.48) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL16966579 0.90 GPR84 (0.59) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL16966580 0.90 GPR84 (0.59) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL1333129 0.90 GPR84 (0.59) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL13409098 0.86 PAOX (0.38) ALDH1A1
SCHEMBL7031615 0.85 MAPT (0.57) PPARGPPARDPPARAPTPN1ALDH1A1
SCHEMBL18212571 0.85 MAPT (0.57) PPARGPPARDPPARAPTPN1ALDH1A1
SCHEMBL3704192 0.85 MAPT (0.57) PPARGPPARDPPARAPTPN1ALDH1A1
SCHEMBL3707984 0.85 MAPT (0.57) PPARGPPARDPPARAPTPN1ALDH1A1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210115679-A1 VINYL COMPOSITION TILE AND METHOD FOR PRODUCING SAME TAJIMA ROOFING INC. (JP) 2021-04-22 US disclosed
US-9834626-B2 Plant oil-based materials NDSU RESEARCH FOUNDATION (US) 2017-12-05 US disclosed
US-9834626-B2 Plant oil-based materials NDSU RESEARCH FOUNDATION (US) 2017-12-05 US disclosed
US-20170321036-A1 ISOSORBIDE EPOXIDE DIESTERS, AND THE USE THEREOF AS A PLASTICIZER IN PVC COMPOSITIONS ROQUETTE FRERES (FR) 2017-11-09 US disclosed
US-20170283615-A1 IMPROVED ASPHALT PRODUCTS AND MATERIALS AND METHODS OF PRODUCING THEM IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2017-10-05 US disclosed
US-9718987-B2 Blocked bio-based carboxylic acids and their use in thermosetting materials NDSU RESEARCH FOUNDATION (US) 2017-08-01 US disclosed
US-20170022386-A1 BLOCKED BIO-BASED CARBOXYLIC ACIDS AND THEIR USE IN THERMOSETTING MATERIALS NDSU RESEARCH FOUNDATION (US) 2017-01-26 US disclosed
WO-2016033605-A1 IMPROVED ASPHALT PRODUCTS AND MATERIALS AND METHODS OF PRODUCING THEM IOWA STATE UNIVERSITY RESEARCH FOUNDATION INC. (US) 2016-03-03 WO disclosed
US-20150368378-A1 PLANT OIL-BASED MATERIALS NDSU RESEARCH FOUNDATION (US) 2015-12-24 US disclosed
US-20150368378-A1 PLANT OIL-BASED MATERIALS NDSU RESEARCH FOUNDATION (US) 2015-12-24 US disclosed
US-7834248-B2 comprising 12,13-epoxy-9-octadecenoic acid; generation of preferential coatings, resins, glues, plastics, surfactants and lubricants from renewable plant sources COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2010-11-16 US disclosed
US-7589253-B2 Fatty acid epoxygenase genes from plants and uses therefor in modifying fatty acid metabolism COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2009-09-15 US disclosed
US-20070209092-A1 Plant seed comprising vernolic acid COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION, BASF PLANT SCIENCE, GMBH 2007-09-06 US disclosed
EP-0975765-B1 PLANT FATTY ACID EPOXYGENASE GENES AND USES THEREFOR COMMW SCIENT IND RES ORG (AU) 2006-10-11 EP disclosed
US-20020166144-A1 Fatty acid epoxygenase genes from plants and uses therefor in modifying fatty acid metabolism BASF PLANT SCIENCE GMBH (DE) 2002-11-07 US disclosed
EP-0975765-A4 PLANT FATTY ACID EPOXYGENASE GENES AND USES THEREFOR COMMW SCIENT IND RES ORG (AU) 2002-09-25 EP disclosed
US-6329518-B1 NUCLEIC ACID FROM CREPIS PLANT CODING FOR ENZYME THAT CATALYZES EPOXYGENATION OF CARBON DOUBLE BOND AT DELTA-12 POSITION OF FATTY ACID; EFFICIENT PRODUCTION OF COATINGS, GLUES, PLASTICS, SURFACTANTS AND LUBRICANTS BASF PLANT SCIENCE GMBH (DE) 2001-12-11 US disclosed
EP-0975765-A1 PLANT FATTY ACID EPOXYGENASE GENES AND USES THEREFOR COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2000-02-02 EP disclosed
WO-1998046762-A1 PLANT FATTY ACID EPOXYGENASE GENES AND USES THEREFOR COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1998-10-22 WO disclosed
US-3960541-A ALIPHATIC EPOXYMONOCARBOXYLIC ACIDS, OR SALTS, ESTERS, OR AMIDES THEREOF CHEMIE LINZ AKTIENGESELLSCHAFT (OE) 1976-06-01 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 (3 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-20170283615-A1 IMPROVED ASPHALT PRODUCTS AND MATERIALS AND METHODS OF PRODUCING THEM PTAR1, LCAT, ANAPC7 GPR84 4559/4885PPARG 3135/4885PPARD 3898/4885
US-20170321036-A1 ISOSORBIDE EPOXIDE DIESTERS, AND THE USE THEREOF AS A PLASTICIZER IN PVC COMPOSITIONS VKORC1, VKORC1L1, DDHD2 GPR84 817/4885PPARG 240/4885PPARD 215/4885
US-20150368378-A1 PLANT OIL-BASED MATERIALS FASN, LIPC, PNLIP GPR84 504/4885PPARG 261/4885PPARD 728/4885

“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.