SCHEMBL1204897

SCHEMBL1204897

CCCC(COC)COC

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL10212062 0.94 CA12 (0.46) CA12CA1CA2CA7CA14
SCHEMBL497722 0.88
SCHEMBL12555548 0.88
SCHEMBL14113755 0.84 CYP3A4 (0.44) CA12CA1CA2CA7CA14
SCHEMBL26230598 0.84
SCHEMBL13568618 0.84 CYP3A4 (0.44) CA12CA1CA2CA7CA14
SCHEMBL17484366 0.84
SCHEMBL17526839 0.84 CYP3A4 (0.44) CA12CA1CA2CA7CA14
SCHEMBL26230599 0.84
SCHEMBL813042 0.82 CYP3A4 (0.47) CA1CA2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113929797-A Solid catalyst component and catalyst system for producing polymers 中国石油化工股份有限公司 2022-01-14 CN claimed
CN-113773424-A Catalyst component for olefin polymerization and application 中国石油化工股份有限公司 2021-12-10 CN claimed
CN-100478369-C Olefin and omega-silane-alpha-olefin copolymer and its preparing method CHINESE ACAD INST CHEMISTRY (CN) 2009-04-15 CN claimed
CN-1935858-A Olefin and omega-silane-alpha-olefin copolymer and its preparing method CHINESE ACAD INST CHEMISTRY (CN) 2007-03-28 CN claimed
US-20230287418-A1 MODIFIED SIRNA WITH REDUCED OFF-TARGET ACTIVITY TUOJIE BIOTECH(SHANGHAI) CO., LTD. (CN) 2023-09-14 US disclosed
CN-113929797-A Solid catalyst component and catalyst system for producing polymers 中国石油化工股份有限公司 2022-01-14 CN disclosed
CN-113773424-A Catalyst component for olefin polymerization and application 中国石油化工股份有限公司 2021-12-10 CN disclosed
CN-112300304-A Catalyst system for olefin polymerization and prepolymerized catalyst composition 中国石油化工股份有限公司 2021-02-02 CN disclosed
EP-3578562-A1 L-VALINATE AMIDE BENZOXABOROLE DERIVATIVES FOR THE TREATMENT OF PARASITIC DISEASES Anacor Pharmaceuticals, Inc (US) 2019-12-11 EP disclosed
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2017-11-02 US disclosed
US-20140135329-A1 Pyridine and Pyrazine derivative for the Treatment of CF BAETTIG URS (GB) 2014-05-15 US disclosed
US-8623621-B2 Method for producing optically active 2-methyl-alkanols BASF SE (DE) 2014-01-07 US disclosed
US-20110045560-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 2-METHYL-ALKANOLS BASF AKTIENGESELLSCHAFT (DE) 2011-02-24 US disclosed
US-7816107-B2 Method for producing an optically active 2-methyl-alkane-1-ol from the corresponding 2-methylalk-2-en-1-al, comprising carbonyl-selective reduction, enantioselective hydration and lipase-catalyzed, stereoselective acylation in order to enrich the desired BASF AKTIENGESELLSCHAFT (DE) 2010-10-19 US disclosed
US-7736620-B2 Europium-diketone chelate compound and fluorescent material using the same NATIONAL UNIVERSITY CORPORATION KYUSHU INSTITUTE OF TECHNOLOGY (JP) 2010-06-15 US disclosed
CN-100478369-C Olefin and omega-silane-alpha-olefin copolymer and its preparing method CHINESE ACAD INST CHEMISTRY (CN) 2009-04-15 CN disclosed
US-20080108117-A1 Method for Producing an Optically Active 2-Methyl-Alkane-1-Ol from the Corresponding 2-Methylalk-2-En-1-Al, Comprising Carbonyl-Selective Reduction, Enantioselective Hydration and Lipase-Catalyzed Stereoselective Acylation in Order to Enrich the Desired BASF AKTIENGESELLSCHAFT (DE) 2008-05-08 US disclosed
EP-1797191-B1 PROESS FOR PRODUCING AN OPTICALLY ACTIVE 2-METHYL-ALKANE-1-OLS FROM THE CORRESPONDING 2-METHYLALK-2-EN-1-ALS, COMPRISING A STEP OF ENANTIOSELECTIVE ACYLATION TO ENRICH ONE ENANTIOMER BASF SE (DE) 2008-04-02 EP disclosed
CN-1935858-A Olefin and omega-silane-alpha-olefin copolymer and its preparing method CHINESE ACAD INST CHEMISTRY (CN) 2007-03-28 CN disclosed
US-4971937-A COORDINATION CATALYSTS OF TITANIUM HALIDES, MAGNESIUM HALIDES AND DI OR POLYETHER COMPOUNDS HIMONT INCORPORATED (US) 1990-11-20 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-20140135329-A1 Pyridine and Pyrazine derivative for the Treatment of CF CFTR, OPRK1, OPRD1 CA12 4266/4885CA1 4833/4885CA2 3279/4885
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR HDGF, F11, F12 CA12 2348/4885CA1 3481/4885CA2 4828/4885

“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.