SCHEMBL696791

SCHEMBL696791

C=C(CCCC)C(=O)N(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
CES1 P23141 6/20 0.44
CES2 O00748 5/20 0.44
TP53 P04637 1/20 0.41
CA1 P00915 1/20 0.39
AKR1B1 P15121 1/20 0.36
PPARG P37231 6/20 0.34
PPARD Q03181 6/20 0.34
PPARA Q07869 6/20 0.34
GPR84 Q9NQS5 5/20 0.34
HDAC11 Q96DB2 5/20 0.34
TSHR P16473 4/20 0.34
TLR2 O60603 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
FABP4 P15090 2/20 0.34
PTPN1 P18031 2/20 0.34
SLC22A6 Q4U2R8 1/20 0.34
SLC22A8 Q8TCC7 1/20 0.34
MEN1 O00255 1/20 0.34
ESR1 P03372 1/20 0.34

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
SCHEMBL10867506 0.91 CES2 (0.48) ALDH1A1CES1CES2PPARGPPARD
SCHEMBL429458 0.86 ALDH1A1 (0.41) ALDH1A1CES1CES2TSHR
SCHEMBL2694671 0.82 CES1 (0.44) ALDH1A1CES1CES2TP53CA1
SCHEMBL93437 0.80 CYP1A2 (0.41) ALDH1A1HDAC11TSHRMEN1ALOX15
SCHEMBL2232037 0.80 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1628754 0.80 LMNA (0.43) ALDH1A1CES1CES2TP53CA1
SCHEMBL8437334 0.80 PAOX (0.36) ALDH1A1TSHR
SCHEMBL747178 0.78 PAOX (0.45) ALDH1A1HDAC11TSHRMEN1ALOX15
SCHEMBL1629289 0.78 CES1 (0.41) ALDH1A1CES1CES2TP53CA1
SCHEMBL1629571 0.78 CA1 (0.47) ALDH1A1CES1CES2TP53CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070099816-A1 Hard Surface Cleaning Composition THE CLOROX COMPANY 2007-05-03 US claimed
EP-0472352-B1 Sludge treatment BETZ EUROP INC (US) 1995-01-04 EP claimed
US-11173106-B2 Compositions comprising a superhydrophilic amphiphilic copolymer and a micellar thickener JOHNSON & JOHNSON CONSUMER INC. (US) 2021-11-16 US disclosed
US-20210114379-A1 IMAGE RECORDING METHOD, INK, AND LIQUID COMPOSITION CANON KK (JP) 2021-04-22 US disclosed
EP-3385343-B1 IMAGE RECORDING METHOD, INK, AND LIQUID COMPOSITION CANON KK (JP) 2021-03-10 EP disclosed
US-10864748-B2 Image recording method, ink, and liquid composition CANON KABUSHIKI KAISHA (JP) 2020-12-15 US disclosed
US-20190126633-A1 IMAGE RECORDING METHOD, INK, AND LIQUID COMPOSITION CANON KK (JP) 2019-05-02 US disclosed
EP-3385343-A1 IMAGE RECORDING METHOD, INK, AND LIQUID COMPOSITION CANON KABUSHIKI KAISHA (JP) 2018-10-10 EP disclosed
US-10065412-B2 Ink jet recording method CANON KABUSHIKI KAISHA (JP) 2018-09-04 US disclosed
EP-3042936-B1 IMAGE RECORDING METHOD, INK, AND LIQUID COMPOSITION CANON KK (JP) 2018-06-13 EP disclosed
US-9981480-B2 Image recording method, ink, and liquid composition CANON KABUSHIKI KAISHA (JP) 2018-05-29 US disclosed
US-20110082290-A1 SUPERHYDROPHILIC AMPHIPHILIC COPOLYMERS AND PROCESSES FOR MAKING THE SAME AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2011-04-07 US disclosed
US-20110082065-A1 COMPOSITIONS COMPRISING A LOW-DP POLYMERIZED SURFACTANT AND A MICELLAR THICKENER KENVUE BRANDS LLC 2011-04-07 US disclosed
US-20110081310-A1 COMPOSITIONS COMPRISING SUPERHYDROPHILIC AMPHIPHILIC COPOLYMERS AND METHODS OF USE THEREOF JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2011-04-07 US disclosed
US-20110081309-A1 COMPOSITIONS COMPRISING A SUPERHYDROPHILIC AMPHIPHILIC COPOLYMER AND A MICELLAR THICKENER KENVUE BRANDS LLC 2011-04-07 US disclosed
US-20110082105-A1 COMPOSITIONS COMPRISING SUPERHYDROPHILIC AMPHIPHILIC COPOLYMERS AND METHODS OF USE THEREOF KENVUE BRANDS LLC 2011-04-07 US disclosed
WO-2010121042-A1 PROCESS FOR ABSORBING AND ADSORBING OIL DEGRADATION PRODUCTS FROM LUBRICATING OILS FLUITEC INTERNATIONAL (US) 2010-10-21 WO disclosed
US-7700540-B2 Hard surface cleaning composition THE CLOROX COMPANY (US) 2010-04-20 US disclosed
US-20080220275-A1 Water-based one package coat and multilayer coating film-forming method KANSAI PAINT CO., LTD. (JP) 2008-09-11 US disclosed
US-20070099816-A1 Hard Surface Cleaning Composition THE CLOROX COMPANY 2007-05-03 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 (5 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-20110082105-A1 COMPOSITIONS COMPRISING SUPERHYDROPHILIC AMPHIPHILIC COPOLYMERS AND METHODS OF USE THEREOF PHOSPHO1, LIPA, ABHD16A ALDH1A1 3439/4885CES1 675/4885CES2 147/4885
US-20110081310-A1 COMPOSITIONS COMPRISING SUPERHYDROPHILIC AMPHIPHILIC COPOLYMERS AND METHODS OF USE THEREOF ABHD16A, LIPA, ABHD12 ALDH1A1 1410/4885CES1 129/4885CES2 15/4885
US-20110081309-A1 COMPOSITIONS COMPRISING A SUPERHYDROPHILIC AMPHIPHILIC COPOLYMER AND A MICELLAR THICKENER ABHD16A, DSG1, CUTA ALDH1A1 2557/4885CES1 134/4885CES2 87/4885
US-20110082065-A1 COMPOSITIONS COMPRISING A LOW-DP POLYMERIZED SURFACTANT AND A MICELLAR THICKENER DSG1, DSP, PSAP ALDH1A1 2483/4885CES1 1466/4885CES2 1794/4885
US-11173106-B2 Compositions comprising a superhydrophilic amphiphilic copolymer and a micellar thickener ABHD16A, DSG1, CUTA ALDH1A1 2557/4885CES1 134/4885CES2 87/4885

“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.