SCHEMBL742996

SCHEMBL742996

CCCCCCCCCCCCCCCC(C)(C)CC(=O)O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.83
FFAR1 O14842 2/20 0.83
CPT2 P23786 1/20 0.83
GPR84 Q9NQS5 7/20 0.48
PPARG P37231 7/20 0.48
PPARD Q03181 7/20 0.48
PPARA Q07869 7/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 4/20 0.48
PTPN1 P18031 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
FABP4 P15090 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
MEN1 O00255 1/20 0.48
ESR1 P03372 1/20 0.48
ALOX15 P16050 1/20 0.48
PDE4A P27815 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL27542041 1.00 TDP1 (0.83) TDP1FFAR1CPT2GPR84PPARG
SCHEMBL12451279 1.00 TDP1 (0.83) TDP1FFAR1CPT2GPR84PPARG
SCHEMBL1114697 1.00 TDP1 (0.83) TDP1FFAR1CPT2GPR84PPARG
SCHEMBL3623870 1.00 TDP1 (0.83) TDP1FFAR1CPT2GPR84PPARG
SCHEMBL1873452 1.00 TDP1 (0.83) TDP1FFAR1CPT2GPR84PPARG
SCHEMBL20184209 1.00 TDP1 (0.83) TDP1FFAR1CPT2GPR84PPARG
SCHEMBL5878804 1.00 TDP1 (0.83) TDP1FFAR1CPT2GPR84PPARG
SCHEMBL22748728 1.00 TDP1 (0.83) TDP1FFAR1CPT2GPR84PPARG
SCHEMBL22748689 1.00 TDP1 (0.83) TDP1FFAR1CPT2GPR84PPARG
Hydrochloric Acid SCHEMBL8110283 0.98 TDP1 (0.79) TDP1FFAR1CPT2GPR84PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1261274-A carboxylic acids and derivatives thereof and pharmaceutical compositions containing them YISSUM RES DEV CO (IL) 2000-07-26 CN claimed
US-20130023683-A1 ALKALI METAL AND ALKALINE EARTH METAL GLYCERATES FOR THE DEACIDIFICATION AND DRYING OF FATTY ACID ESTERS EVONIK DEGUSSA GMBH (DE) 2013-01-24 US disclosed
EP-2548937-A1 Alkali and earth alkali metal glycerates for drying and deacidification of fatty acid esters Evonik Degussa GmbH (DE) 2013-01-23 EP disclosed
CN-102888278-A Alkali and alkaline earth metal glycerates for deacidification and drying of fatty acid esters EVONIK DEGUSSA GMBH 2013-01-23 CN disclosed
CN-102430426-A Catalyst system for biodiesel production EVONIK DEGUSSA GMBH 2012-05-02 CN disclosed
US-20120066965-A1 CATALYST SYSTEMS FOR BIODIESEL PRODUCTION EVONIK DEGUSSA GMBH (DE) 2012-03-22 US disclosed
EP-2431352-A2 Catalyst systems for biodiesel production Evonik Degussa GmbH (DE) 2012-03-21 EP disclosed
US-7789934-B2 Combination of an N-alkyl- or N,N-dialkylpolyhydroxyalkanamide and a metal soap, an alkylenebisfatty amide, or an N-alkylalkanamide; improves both flowability and lubricity, regardless of a presence or absence of a complicated pretreatment step. KABUSHIKI KAISHA KOBE SEIKO SHO (JP) 2010-09-07 US disclosed
CN-101129349-A Carboxylic acids and derivatives thereof and pharmaceutical compositions containing them YISSUM RES DEV CO (IL) 2008-02-27 CN disclosed
US-20070154340-A1 Lubricant for powder metallurgy, powdery mixture for powder metallurgy, and process for producing sinter KABUSHIKI KAISHA KOBE SEIKO SHO (JP) 2007-07-05 US disclosed
US-6838544-B2 Polyol polymers, meso-erythritol polymers and their aliphatic acid esters and aliphatic ethers RENGO CO., LTD. (JP) 2005-01-04 US disclosed
US-20030017132-A1 Polyol polymers, meso-erythritol polymers and their aliphatic acid esters and aliphatic ethers RENGO CO., LTD. (JP) 2003-01-23 US disclosed
EP-1264853-A2 Polyol polymers, meso erythritol polymers and their aliphatic acid esters and aliphatic ethers Rengo Co., Ltd. (JP) 2002-12-11 EP disclosed
CN-1261274-A carboxylic acids and derivatives thereof and pharmaceutical compositions containing them YISSUM RES DEV CO (IL) 2000-07-26 CN disclosed
EP-0273173-B1 PROCESS FOR THE PREPARATION OF FATTY ACID NITRILES AND GLYCERIN FROM GLYCERIDES HOECHST AKTIENGESELLSCHAFT (DE) 1991-07-03 EP disclosed
US-4801730-A Process for the preparation of fatty acid nitriles and glycerol from glycerides HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-31 US disclosed
US-4668439-A Process for the preparation of fatty acid esters of short-chain alcohols HOECHST AKTIENGESELLSCHAFT (DE) 1987-05-26 US disclosed
CN-85106282-A The preparation method of short-link alcohol fatty acid ester 1987-02-18 CN disclosed
EP-0164643-A2 Process for the production of fatty acid esters of short-chain alcohols HOECHST AKTIENGESELLSCHAFT (DE) 1985-12-18 EP disclosed
US-4234509-A METAL SALTS OF CARBOXYLIC OR SULFONIC ACIDS HOECHST AKTIENGESELLSCHAFT (DE) 1980-11-18 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 (2 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-20030017132-A1 Polyol polymers, meso-erythritol polymers and their aliphatic acid esters and aliphatic ethers PARG, EBPL, AGL TDP1 1803/4885FFAR1 2323/4885CPT2 803/4885
US-20120066965-A1 CATALYST SYSTEMS FOR BIODIESEL PRODUCTION LIPC, LIPA, CEL TDP1 889/4885FFAR1 369/4885CPT2 367/4885

“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.