SCHEMBL608116

SCHEMBL608116

CCCCCCC(CC)(CO)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
CES2 O00748 1/20 0.41
GPR84 Q9NQS5 7/20 0.40
PPARG P37231 7/20 0.40
PPARD Q03181 7/20 0.40
PPARA Q07869 7/20 0.40
HDAC11 Q96DB2 5/20 0.40
TSHR P16473 4/20 0.40
PTPN1 P18031 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TLR2 O60603 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
FABP4 P15090 2/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
SLC22A8 Q8TCC7 1/20 0.40
MEN1 O00255 1/20 0.40
ESR1 P03372 1/20 0.40
ALOX15 P16050 1/20 0.40
PDE4A P27815 1/20 0.40

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
SCHEMBL28956794 1.00 CYP4F2 (0.42) CYP4F2CYP4A11CES2GPR84PPARG
SCHEMBL14715848 0.92 CES2 (0.44) CES2GPR84PPARGPPARDPPARA
SCHEMBL513791 0.92 CES2 (0.44) CES2GPR84PPARGPPARDPPARA
SCHEMBL2844700 0.92 CYP4F2 (0.40) CYP4F2CYP4A11GPR84PPARGPPARD
SCHEMBL10674027 0.92 CES2 (0.44) CES2GPR84PPARGPPARDPPARA
SCHEMBL14716164 0.92 CES2 (0.44) CES2GPR84PPARGPPARDPPARA
SCHEMBL12196374 0.92 CYP4F2 (0.40) CYP4F2CYP4A11GPR84PPARGPPARD
SCHEMBL6755330 0.92 CES2 (0.44) CES2GPR84PPARGPPARDPPARA
SCHEMBL2142785 0.92 CES2 (0.44) CES2GPR84PPARGPPARDPPARA
SCHEMBL14715979 0.92 CES2 (0.44) CES2GPR84PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070224213-A1 Pharmaceutical Composition Comprising an Extract or Compounds Isolated from Elfvingia Applanata for the Prevention and the Treatment of Diabetes and Diabetic Complications SON, DAL-HOON (CA) 2007-09-27 US claimed
US-9861941-B2 Modified sulfonated block copolymers and the preparation thereof KRATON POLYMERS U.S. LLC (US) 2018-01-09 US disclosed
EP-2731998-B1 MODIFIED SULFONATED BLOCK COPOLYMERS AND THE PREPARATION THEREOF KRATON POLYMERS US LLC (US) 2016-05-18 EP disclosed
EP-2731998-A1 MODIFIED SULFONATED BLOCK COPOLYMERS AND THE PREPARATION THEREOF Kraton Polymers US LLC (US) 2014-05-21 EP disclosed
WO-2013025271-A1 MODIFIED SULFONATED BLOCK COPOLYMERS AND THE PREPARATION THEREOF KRATON POLYMERS U.S. LLC (US) 2013-02-21 WO disclosed
US-20130015071-A1 MODIFIED SULFONATED BLOCK COPOLYMERS AND THE PREPARATION THEREOF KRATON POLYMERS U.S. LLC (US) 2013-01-17 US disclosed
EP-2539317-A2 DIHYDROLIPOIC ACID DERIVATIVES COMPRISING NITRIC OXIDE AND THERAPEUTIC USES THEREOF Invasc Therapeutics, Inc. (US) 2013-01-02 EP disclosed
US-20120041025-A1 Dihydrolipoic Acid Derivatives Comprising Nitric Oxide and Therapeutic Uses Thereof CARMEL BIOSCIENCES, INC. 2012-02-16 US disclosed
US-20110257130-A1 Compositions and Methods for Treatment of Renin-Angiotensin Aldosterone System (RAAS)- Related Disorders CARMEL BIOSCIENCES, INC. 2011-10-20 US disclosed
EP-2358707-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF RENIN-ANGIOTENSIN ALDOSTERONE SYSTEM (RAAS)-RELATED DISORDERS Invasc Therapeutic, Inc. (US) 2011-08-24 EP disclosed
WO-2004026864-A1 HETEROCYCLIC SUBSTITUTED PIPERAZINES FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC (US) 2004-04-01 WO disclosed
US-6613914-B2 Reacting an aromatic ketone with succinic anhydride and an alkoxide base to form an intermediate, reacting the intermediate with an alcohol to form ester, then reacting formed ester with N-methylhydroxylamine hydrochloride ORTHO-MCNEIL PHARMACEUTICAL, INC. 2003-09-02 US disclosed
US-20030045537-A1 4-(Phenylamino)-[1,4]dioxano[2,3-g]quinazoline derivatives and process for preparing the same KOREAN INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2003-03-06 US disclosed
US-20020128487-A1 Process for preparing 1, 5-diaryl-3-substituted pyrazoles ABDEL-MAGID AHMED F (US) 2002-09-12 US disclosed
EP-1144382-A3 PROCESS FOR PREPARING 1,5-DIARYL-3-SUBSTITUTED PYRAZOLES Ortho-McNeil Pharmaceutical, Inc. (US) 2002-09-11 EP disclosed
US-20020032336-A1 Process for preparing 1,5-diaryl-3-substituted pyrazoles ABDEL-MAGID AHMED F (US) 2002-03-14 US disclosed
EP-1144382-A2 PROCESS FOR PREPARING 1,5-DIARYL-3-SUBSTITUTED PYRAZOLES Ortho-McNeil Pharmaceutical, Inc. (US) 2001-10-17 EP disclosed
WO-2001009102-A2 PROCESS FOR PREPARING 1,5-DIARYL-3-SUBSTITUTED PYRAZOLES ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2001-02-08 WO disclosed
US-4935503-A One step; using peroxydisulfate, ferrous, azide, and chloride salt BIOMIRA, INC. (CA) 1990-06-19 US disclosed
EP-0340780-A2 Azidochlorination and diazidization of glycals BIOMIRA, INC. (CA) 1989-11-08 EP 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-20030045537-A1 4-(Phenylamino)-[1,4]dioxano[2,3-g]quinazoline derivatives and process for preparing the same EGFR, ERBB2, ERBB4 CYP4F2 1478/4885CYP4A11 1737/4885CES2 3832/4885
US-20020032336-A1 Process for preparing 1,5-diaryl-3-substituted pyrazoles ADH5, ADH1C, ADH1A CYP4F2 26/4885CYP4A11 23/4885CES2 938/4885
US-20120041025-A1 Dihydrolipoic Acid Derivatives Comprising Nitric Oxide and Therapeutic Uses Thereof DLD, LDLR, ALOX15 CYP4F2 1596/4885CYP4A11 605/4885CES2 2932/4885
US-20070224213-A1 Pharmaceutical Composition Comprising an Extract or Compounds Isolated from Elfvingia Applanata for the Prevention and the Treatment of Diabetes and Diabetic Complications DPP7, DPP4, ELF3 CYP4F2 143/4885CYP4A11 59/4885CES2 3690/4885
US-20020128487-A1 Process for preparing 1, 5-diaryl-3-substituted pyrazoles ADH5, ADH1C, ADH1A CYP4F2 26/4885CYP4A11 23/4885CES2 938/4885
US-20110257130-A1 Compositions and Methods for Treatment of Renin-Angiotensin Aldosterone System (RAAS)- Related Disorders REN, ACE, AGT CYP4F2 722/4885CYP4A11 144/4885CES2 1564/4885

“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.