SCHEMBL7601504

SCHEMBL7601504

C/C=C(\CC)C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.46
GLO1 Q04760 1/20 0.46
SOAT1 P35610 1/20 0.46
ALDH1A1 P00352 5/20 0.43
LMNA P02545 3/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP2D6 P10635 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
EGLN1 Q9GZT9 1/20 0.39
CYP2C9 P11712 2/20 0.38
HCAR2 Q8TDS4 1/20 0.38
MAPT P10636 3/20 0.38

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
SCHEMBL7600152 1.00 NPSR1 (0.46) NPSR1GLO1SOAT1ALDH1A1LMNA
SCHEMBL6044972 0.83 NPSR1 (0.45) NPSR1GLO1SOAT1ALDH1A1LMNA
SCHEMBL12317093 0.83 NPSR1 (0.45) NPSR1GLO1SOAT1ALDH1A1LMNA
SCHEMBL9889451 0.83 NPSR1 (0.45) NPSR1GLO1SOAT1ALDH1A1LMNA
SCHEMBL8160444 0.81 NPSR1 (0.43) NPSR1GLO1SOAT1ALDH1A1LMNA
SCHEMBL5144385 0.81 NPSR1 (0.43) NPSR1GLO1SOAT1ALDH1A1LMNA
SCHEMBL9281644 0.81 NPSR1 (0.43) NPSR1GLO1SOAT1ALDH1A1LMNA
SCHEMBL5963299 0.81 ALDH1A1 (0.50) NPSR1GLO1SOAT1ALDH1A1LMNA
SCHEMBL5963296 0.81 ALDH1A1 (0.50) NPSR1GLO1SOAT1ALDH1A1LMNA
SCHEMBL8583764 0.81 NPSR1 (0.43) NPSR1GLO1SOAT1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230399327-A1 HIGH ACTIVITY HPK1 KINASE INHIBITOR ADLAI NORTYE BIOPHARMA CO., LTD. (CN) 2023-12-14 US disclosed
US-20230212183-A9 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-07-06 US disclosed
US-20180207140-A1 Pyrazolopyrimidines as Inhibitors of Glucocorticoid Receptor Translocation Sanford Burnham Prebys Medical Discovery Institute 2018-07-26 US disclosed
US-10011600-B2 Methods and compositions for inhibition of Ras ARAXES PHARMA LLC (US) 2018-07-03 US disclosed
US-20180140523-A1 ALKALINE AGENT FOR LIGHTENING HAIR CONTAINING OXIDANTS AND SPECIAL CARBOXYLIC ACID ESTERS HENKEL AG & CO. KGAA (DE) 2018-05-24 US disclosed
US-20180127373-A1 PROCESS FOR THE SYNTHESIS OF IVACAFTOR AND RELATED COMPOUNDS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2018-05-10 US disclosed
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-05-03 US disclosed
US-9931334-B2 Solid forms of N[2,4-bis(1,1-dimethylethyl)-5-hydroxyphenyl]-1,4-dihydro-4-oxoquinoline-3-carboxamide VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-04-03 US disclosed
US-20180071297-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS VTV THERAPEUTICS LLC 2018-03-15 US disclosed
US-9840516-B2 Substituted quinazolines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2017-12-12 US disclosed
US-20110053934-A1 COMPOUNDS AND METHODS OF TREATMENT GLAXOSMITHKLINE LLC (US) 2011-03-03 US disclosed
US-6441044-B1 CROP PROTECTION AGENT BASF AKTIENGESELLSCHAFT (DE) 2002-08-27 US disclosed
EP-0401286-B1 PROCESS FOR PREPARING N-(HYDROXYALKYL)-2-UNSATURATED AMIDES AND 2-ALKENYL OXAZOLINES DOW CHEMICAL CO (US) 1995-09-13 EP disclosed
EP-0341475-B1 STEREO ISOMERS OF N-(R)-1-ARYL-ETHYL)-1-ALKYL-2,2-DICHLOROCYCLOPROPANE CARBOXAMIDE BAYER AG (DE) 1993-09-29 EP disclosed
EP-0401286-A4 PROCESS FOR PREPARING N-(HYDROXYALKYL)-2-UNSATURATED AMIDES AND 2-ALKENYL OXAZOLINES DOW CHEMICAL CO (US) 1991-07-24 EP disclosed
US-5034536-A Amidation of an ester in the presence of a polymerization inhibitor THE DOW CHEMICAL COMPANY (US) 1991-07-23 US disclosed
US-4988734-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1991-01-29 US disclosed
EP-0401286-A1 PROCESS FOR PREPARING N-(HYDROXYALKYL)-2-UNSATURATED AMIDES AND 2-ALKENYL OXAZOLINES. DOW CHEMICAL CO (US) 1990-12-12 EP disclosed
EP-0341475-A2 Stereo isomers of N-(R)-1-aryl-ethyl)-1-alkyl-2,2-dichlorocyclopropane carboxamide BAYER AG (DE) 1989-11-15 EP disclosed
WO-1989008099-A1 PROCESS FOR PREPARING N-(HYDROXYALKYL)-2-UNSATURATED AMIDES AND 2-ALKENYL OXAZOLINES THE DOW CHEMICAL COMPANY (US) 1989-09-08 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 (9 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-20180207140-A1 Pyrazolopyrimidines as Inhibitors of Glucocorticoid Receptor Translocation NR3C1, NR3C2, GRK3 NPSR1 679/4885GLO1 3604/4885SOAT1 1129/4885
US-20180127373-A1 PROCESS FOR THE SYNTHESIS OF IVACAFTOR AND RELATED COMPOUNDS AVPR1A, ACVR1, AVPR2 NPSR1 272/4885GLO1 3128/4885SOAT1 1780/4885
US-20230399327-A1 HIGH ACTIVITY HPK1 KINASE INHIBITOR MAP3K9, MAP3K1, MAP3K15 NPSR1 4732/4885GLO1 4041/4885SOAT1 2653/4885
US-20110053934-A1 COMPOUNDS AND METHODS OF TREATMENT RET, ABL1, PRKACA NPSR1 3649/4885GLO1 4469/4885SOAT1 3049/4885
US-20180118757-A1 SUBSTITUTED QUINAZOLINES AS INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS NPSR1 4618/4885GLO1 1508/4885SOAT1 4586/4885
US-20180071297-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS PDE4A, PDE4B, PDE4C NPSR1 3394/4885GLO1 3345/4885SOAT1 2741/4885
US-20230212183-A9 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS NPSR1 4528/4885GLO1 1529/4885SOAT1 4249/4885
US-10011600-B2 Methods and compositions for inhibition of Ras KRAS, NRAS, HRAS NPSR1 4689/4885GLO1 1761/4885SOAT1 3597/4885
US-20180140523-A1 ALKALINE AGENT FOR LIGHTENING HAIR CONTAINING OXIDANTS AND SPECIAL CARBOXYLIC ACID ESTERS KRT18, ALDH7A1, ALDH1A2 NPSR1 4234/4885GLO1 980/4885SOAT1 2545/4885

“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.