SCHEMBL2901080

SCHEMBL2901080

[CH2]CCOC(=O)OCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
HCAR2 Q8TDS4 1/20 0.40
LMNA P02545 2/20 0.38
TSHR P16473 4/20 0.36
ESR1 P03372 1/20 0.36
CHRM1 P11229 1/20 0.36
SLC6A2 P23975 1/20 0.36
KDR P35968 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HPGD P15428 1/20 0.35
SOAT1 P35610 1/20 0.35
ATM Q13315 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
NAAA Q02083 1/20 0.32
DGKA P23743 1/20 0.32
PPM1B O75688 1/20 0.32
PTPN1 P18031 1/20 0.32
PPP1CC P36873 1/20 0.32
ACHE P22303 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
Ethylene SCHEMBL29245194 0.87 ALDH1A1 (0.50) ALDH1A1HCAR2LMNATSHRESR1
SCHEMBL17057 0.87 ALDH1A1 (0.56) ALDH1A1HCAR2LMNATSHRESR1
SCHEMBL2904163 0.86 ALDH1A1 (0.54) ALDH1A1HCAR2LMNATSHRESR1
SCHEMBL2906107 0.86 ALDH1A1 (0.43) ALDH1A1HCAR2LMNATSHRHPGD
SCHEMBL698834 0.85
SCHEMBL2837201 0.85
SCHEMBL4034966 0.84 NAAA (0.52) ALDH1A1HCAR2LMNATSHRHPGD
SCHEMBL13465919 0.84 ALDH1A1 (0.53) ALDH1A1HCAR2LMNATSHRESR1
Fluoride SCHEMBL29068323 0.84 ALDH1A1 (0.53) ALDH1A1HCAR2LMNATSHRESR1
SCHEMBL6934821 0.84 ALDH1A1 (0.53) ALDH1A1HCAR2LMNATSHRESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108239424-B transparent silane modified nano montmorillonite dispersion liquid and preparation method and application thereof 中国科学院化学研究所 2020-01-31 CN claimed
CN-118108899-A Curable resin composition, cured product, and method for producing cured product 东京应化工业株式会社 2024-05-31 CN disclosed
CN-118109069-A Resin composition, cured product, and method for producing cured product 东京应化工业株式会社 2024-05-31 CN disclosed
CN-108239424-B transparent silane modified nano montmorillonite dispersion liquid and preparation method and application thereof 中国科学院化学研究所 2020-01-31 CN disclosed
EP-2217564-A1 COMPLEX PANTOIC ACID ESTER NEOPENTYL SULFONYL ESTER CYCLIZATION RELEASE PRODRUGS OF ACAMPROSATE, COMPOSITIONS THEREOF, AND METHODS OF USE XenoPort, Inc. (US) 2010-08-18 EP disclosed
WO-2010035032-A1 CALCIUM ION CHANNEL MODULATORS & USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2010-04-01 WO disclosed
WO-2009133387-A1 INDOLE- 3 -GLYOXYLAMIDE DERIVATIVES FOR USE AS CALCIUM ION CHANNEL MODULATORS LECTUS THERAPEUTICS LIMITED (GB) 2009-11-05 WO disclosed
US-20090076147-A1 COMPLEX PANTOIC ACID ESTER NEOPENTYL SULFONYL ESTER CYCLIZATION RELEASE PRODRUGS OF ACAMPROSATE, COMPOSITIONS THEREOF, AND METHODS OF USE XENOPORT, INC. 2009-03-19 US disclosed
WO-2009033054-A1 COMPLEX PANTOIC ACID ESTER NEOPENTYL SULFONYL ESTER CYCLIZATION RELEASE PRODRUGS OF ACAMPROSATE, COMPOSITIONS THEREOF, AND METHODS OF USE XENOPORT, INC. (US) 2009-03-12 WO disclosed
EP-1919290-A2 METHODS AND PRODUCTS FOR TREATMENT OF DISEASES DMI Biosciences, Inc. (US) 2008-05-14 EP disclosed
WO-1996003462-A1 AZO DYES HAVING A COUPLING COMPONENT FROM THE AMINOTHIAZOLE SERIES BASF AKTIENGESELLSCHAFT (DE) 1996-02-08 WO disclosed
EP-0680834-A1 Thermotransfer of pyridone dyes BASF AKTIENGESELLSCHAFT (DE) 1995-11-08 EP disclosed
EP-0480252-B1 Pyridone dyes and a method for their thermal transfer BASF AG (DE) 1995-07-26 EP disclosed
WO-1995017470-A1 PYRIDONE DYES BASF AKTIENGESELLSCHAFT (DE) 1995-06-29 WO disclosed
US-5310942-A Pyridone dyes and thermal transfer thereof BASF AKTIENGESELLSCHAFT (DE) 1994-05-10 US disclosed
US-5225548-A Printing BASF AKTIENGESELLSCHAFT (DE) 1993-07-06 US disclosed
US-5218120-A Used in thermal transfer process BASF AKTIENGESELLSCHAFT (DE) 1993-06-08 US disclosed
EP-0480252-A1 Pyridone dyes and a method for their thermal transfer BASF Aktiengesellschaft (DE) 1992-04-15 EP disclosed
EP-0480281-A1 Indophenoldyes and a procedure for their thermal transfer BASF Aktiengesellschaft (DE) 1992-04-15 EP disclosed
EP-0479068-A1 Chinolinmethin dyes and process for their thermal transfer BASF Aktiengesellschaft (DE) 1992-04-08 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 (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-20090076147-A1 COMPLEX PANTOIC ACID ESTER NEOPENTYL SULFONYL ESTER CYCLIZATION RELEASE PRODRUGS OF ACAMPROSATE, COMPOSITIONS THEREOF, AND METHODS OF USE ADSL, SLC19A1, SLC25A21 ALDH1A1 1514/4885HCAR2 427/4885LMNA 2544/4885

“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.