SCHEMBL4098549

SCHEMBL4098549

CCNCCOP(=O)(O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAT1 P21673 1/20 0.53
LPAR3 Q9UBY5 8/20 0.48
LPAR2 Q9HBW0 7/20 0.48
LPAR1 Q92633 5/20 0.48
ENPP2 Q13822 1/20 0.41
TPI1 P60174 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
CYP2C19 P33261 2/20 0.35
MEN1 O00255 1/20 0.35
GLA P06280 1/20 0.35
KMT2A Q03164 1/20 0.35
S1PR2 O95136 2/20 0.33
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
S1PR5 Q9H228 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL18501085 0.87 SAT1 (0.70) SAT1LPAR3LPAR2LPAR1ENPP2
SCHEMBL17859165 0.85 LPAR3 (0.44) SAT1LPAR3LPAR2LPAR1ENPP2
SCHEMBL6528738 0.84 LPAR3 (0.52) SAT1LPAR3LPAR2LPAR1ENPP2
SCHEMBL18501086 0.82 LPAR3 (0.43) SAT1LPAR3LPAR2LPAR1ENPP2
SCHEMBL10951281 0.81 CYP3A4 (0.48) SAT1CA12CA1CA2CA9
SCHEMBL13400489 0.81 LPAR3 (0.59) SAT1LPAR3LPAR2LPAR1ENPP2
SCHEMBL5978775 0.79 LPAR3 (0.62) SAT1LPAR3LPAR2LPAR1ENPP2
Diethylamine SCHEMBL10716099 0.78 LPAR3 (0.67) SAT1LPAR3LPAR2LPAR1ENPP2
SCHEMBL7108271 0.78 LPAR3 (0.66) SAT1LPAR3LPAR2LPAR1ENPP2
SCHEMBL9320338 0.78 LPAR3 (0.66) SAT1LPAR3LPAR2LPAR1ENPP2

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109112819-A Stabilized hydrogen peroxide agent prescription 余赛尔 2019-01-01 CN claimed
CN-109023991-A A kind of woven fabric dispersion printing technology 浙江新三印印染有限公司 2018-12-18 CN claimed
CN-108914549-A A kind of Alkali Weight Reduction Treatment of Polyester processing method 浙江滨康印染有限公司 2018-11-30 CN claimed
CN-108585221-A Multifunctional environment-friendly sewage treatment composite reagent and preparation method and application thereof 中山国晟生物工程有限公司 2018-09-28 CN claimed
CN-105803459-A Micro-electronic multilayer metal film etching liquid and application thereof 苏州晶瑞化学股份有限公司 2016-07-27 CN claimed
EP-3615586-B1 BIODEGRADABLE BONE GLUE EVONIK OPERATIONS GMBH (DE) 2021-02-17 EP disclosed
CN-109621658-A A kind of anion formaldehyde purifying agent 惠州市骏新环保科技有限公司 2019-04-16 CN disclosed
CN-105803459-B A kind of microelectronics metal multilayer film etching solution and its application 苏州晶瑞化学股份有限公司 2019-01-15 CN disclosed
CN-105803459-B A kind of microelectronics metal multilayer film etching solution and its application 苏州晶瑞化学股份有限公司 2019-01-15 CN disclosed
CN-109112819-A Stabilized hydrogen peroxide agent prescription 余赛尔 2019-01-01 CN disclosed
CN-109112819-A Stabilized hydrogen peroxide agent prescription 余赛尔 2019-01-01 CN disclosed
CN-109023991-A A kind of woven fabric dispersion printing technology 浙江新三印印染有限公司 2018-12-18 CN disclosed
CN-108914549-A A kind of Alkali Weight Reduction Treatment of Polyester processing method 浙江滨康印染有限公司 2018-11-30 CN disclosed
CN-108585221-A Multifunctional environment-friendly sewage treatment composite reagent and preparation method and application thereof 中山国晟生物工程有限公司 2018-09-28 CN disclosed
US-9567358-B2 Methods of treatment using N-(3-fluorophenyl)-2-{3-[(7-{3-[ethyl(2-hydroxyethyl)amino]propoxy}-quinazolin-4-yl)amino]-1H-pyrazol-5-yl}acetamide ASTRAZENECA AB (SE) 2017-02-14 US disclosed
CN-103882002-B The preparation of a kind of immobilization proteinase reagent and application thereof 中国人民解放军军事医学科学院放射与辐射医学研究所 2016-10-19 CN disclosed
CN-105803459-A Micro-electronic multilayer metal film etching liquid and application thereof 苏州晶瑞化学股份有限公司 2016-07-27 CN disclosed
US-20120115108-A1 POLYMERIZABLE PHOSPHORIC ACID DERIVATIVES COMPRISING A POLYALICYLIC STRUCTURE ELEMENT VOCO GMBH (DE) 2012-05-10 US disclosed
WO-2000024750-A1 RETINOID GLYCEROL PHOSPHOLIPID CONJUGATES CLARION PHARMACEUTICALS, INC. (US) 2000-05-04 WO 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 (1 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-20120115108-A1 POLYMERIZABLE PHOSPHORIC ACID DERIVATIVES COMPRISING A POLYALICYLIC STRUCTURE ELEMENT CAD, PCBP1, PPIP5K2 SAT1 1818/4885LPAR3 3273/4885LPAR2 2660/4885

“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.