SCHEMBL514850

SCHEMBL514850

C=CCCCCCCC(=O)OCC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.67
LMNA P02545 2/20 0.67
TSHR P16473 3/20 0.60
CYP3A4 P08684 2/20 0.60
ALOX15 P16050 1/20 0.60
HSD17B10 Q99714 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
MAPT P10636 2/20 0.53
ABCC4 O15439 1/20 0.53
CYP1A2 P05177 1/20 0.52
GAA P10253 1/20 0.50
NR1I2 O75469 1/20 0.50
PGR P06401 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
PTGS2 P35354 1/20 0.50
PDE4D Q08499 1/20 0.50
DGKA P23743 2/20 0.47
USP2 O75604 1/20 0.45
RECQL P46063 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL53665 1.00 ALDH1A1 (0.67) ALDH1A1LMNATSHRCYP3A4ALOX15
SCHEMBL9571592 1.00 ALDH1A1 (0.67) ALDH1A1LMNATSHRCYP3A4ALOX15
SCHEMBL1006866 1.00 ALDH1A1 (0.67) ALDH1A1LMNATSHRCYP3A4ALOX15
SCHEMBL27637046 1.00 ALDH1A1 (0.67) ALDH1A1LMNATSHRCYP3A4ALOX15
SCHEMBL25329633 1.00 ALDH1A1 (0.67) ALDH1A1LMNATSHRCYP3A4ALOX15
SCHEMBL514798 1.00 ALDH1A1 (0.67) ALDH1A1LMNATSHRCYP3A4ALOX15
SCHEMBL25330787 1.00 ALDH1A1 (0.67) ALDH1A1LMNATSHRCYP3A4ALOX15
SCHEMBL8429929 1.00 ALDH1A1 (0.67) ALDH1A1LMNATSHRCYP3A4ALOX15
SCHEMBL817977 1.00 ALDH1A1 (0.67) ALDH1A1LMNATSHRCYP3A4ALOX15
Ammonia Solution, Strong SCHEMBL3968809 0.98 ALDH1A1 (0.65) ALDH1A1LMNATSHRCYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10199638-B2 Composite anode active material, method of preparing the same, and anode and lithium secondary battery including the composite anode active material SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-02-05 US claimed
CN-105742584-A Composite anode active material, method of preparing the same, and anode and lithium secondary battery 三星电子株式会社 2016-07-06 CN claimed
US-20160190548-A1 COMPOSITE ANODE ACTIVE MATERIAL, METHOD OF PREPARING THE SAME, AND ANODE AND LITHIUM SECONDARY BATTERY INCLUDING THE COMPOSITE ANODE ACTIVE MATERIAL SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 US claimed
US-20190284152-A1 Maleinated Derivatives ELEVANCE RENEWABLE SCIENCES, INC. (US) 2019-09-19 US disclosed
US-10294210-B2 Maleinated derivatives ELEVANCE RENEWABLE SCIENCES, INC. (US) 2019-05-21 US disclosed
US-10199638-B2 Composite anode active material, method of preparing the same, and anode and lithium secondary battery including the composite anode active material SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-02-05 US disclosed
US-20180111912-A1 Maleinated Derivatives ELEVANCE RENEWABLE SCIENCES, INC. (US) 2018-04-26 US disclosed
US-9896424-B2 Methods of making sulfurized derivatives ELEVANCE RENEWABLE SCIENCES, INC. (US) 2018-02-20 US disclosed
US-9738618-B2 Malienated derivatives ELEVANCE RENEWABLE SCIENCES, INC. (US) 2017-08-22 US disclosed
US-20160355492-A1 Methods of Making Sulfurized Derivatives ELEVANCE RENEWABLE SCIENCES, INC. (US) 2016-12-08 US disclosed
US-9440891-B2 Palladium-catalyzed decarbonylation of fatty acid anhydrides for the production of linear alpha olefins CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2016-09-13 US disclosed
CN-1737016-A Polar group-containing olefin copolymer, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS INC (JP) 2006-02-22 CN disclosed
CN-1737017-A Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS INC (JP) 2006-02-22 CN disclosed
CN-1219800-C Polar group-containing olefin copolymer, thermoplastic resin composition containing the same, and use thereof MITSUI CHEMICALS INC (JP) 2005-09-21 CN disclosed
CN-1639187-A Macrocyclic peptides active against the hepatitis C virus BOEHRINGER INGELHEIM CA LTD (CA) 2005-07-13 CN disclosed
US-20040122192-A1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. 2004-06-24 US disclosed
CN-1414941-A Compounds having hydroxycarbonyl-haloalkyl side chains CHUGAI PHARMACEUTICAL CO LTD (JP) 2003-04-30 CN disclosed
US-20020156207-A1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. (JP) 2002-10-24 US disclosed
CN-1342715-A Polar group-containing olefin copolymer, process for producing the same, thermoplastic resin composition containing the same, and use thereof MITSUI CHEMICALS INC (JP) 2002-04-03 CN disclosed
EP-1186619-A2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition contaning the copolymer, and uses thereof Mitsui Chemicals, Inc. (JP) 2002-03-13 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 (4 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-20180111912-A1 Maleinated Derivatives SMOX, SRM, PADI2 ALDH1A1 383/4885LMNA 1847/4885TSHR 4723/4885
US-20190284152-A1 Maleinated Derivatives SMOX, SRM, PADI2 ALDH1A1 383/4885LMNA 1847/4885TSHR 4723/4885
US-20160355492-A1 Methods of Making Sulfurized Derivatives GPX4, CBS, ESD ALDH1A1 769/4885LMNA 4738/4885TSHR 4776/4885
US-10294210-B2 Maleinated derivatives SMOX, SRM, PADI2 ALDH1A1 385/4885LMNA 1892/4885TSHR 4719/4885

“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.