SCHEMBL204649

SCHEMBL204649

CC(=O)OC(CCCl)OC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
TBXA2R P21731 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
GALR3 O60755 1/20 0.35
MAPT P10636 1/20 0.35
BLM P54132 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
ALOX15 P16050 1/20 0.33
LMNA P02545 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
HRH1 P35367 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 3/20 0.31
HSD17B10 Q99714 1/20 0.31
FAAH O00519 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
SCHEMBL9775697 0.91 TSHR (0.36) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL10782810 0.84 TSHR (0.50) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL2230506 0.79 TSHR (0.46) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL202086 0.78
SCHEMBL7556851 0.78
SCHEMBL10786488 0.77 TSHR (0.43) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL190306 0.77 TSHR (0.43) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL18732098 0.76
SCHEMBL6897262 0.75 TSHR (0.42) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL27640082 0.75 TSHR (0.42) TSHRCHRM2CHRM4CHRM1TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181979-B1 Conversion of a multihydroxylated aliphatic hydrocarbon or ester thereof to a chlorohydrin DOW GLOBAL TECHNOLOGIES LLC (US) 2015-04-22 EP disclosed
EP-2174925-B1 Conversion of a multihydroxylated-aliphatic hydrocarbon or ester thereof to a chlorohydrin DOW GLOBAL TECHNOLOGIES LLC (US) 2014-10-15 EP disclosed
US-8404905-B2 Batch, semi-continuous or continuous hydrochlorination of glycerin with reduced volatile chlorinated hydrocarbon by-products and chloroacetone levels DOW GLOBAL TECHNOLOGIES LLC (US) 2013-03-26 US disclosed
US-8304563-B2 Batch, semi-continuous or continuous hydrochlorination of glycerin with reduced volatile chlorinated hydrocarbon by-products and chloroacetone levels DOW GLOBAL TECHNOLOGIES LLC (US) 2012-11-06 US disclosed
US-8236975-B2 Process for the conversion of a crude glycerol, crude mixtures of naturally derived multicomponent aliphatic hydrocarbons or esters thereof to a chlorohydrin DOW GLOBAL TECHNOLOGIES LLC 2012-08-07 US disclosed
US-8088957-B2 Conversion of a multihydroxylated-aliphatic hydrocarbon or ester thereof to a chlorohydrin DOW GLOBAL TECHNOLOGIES LLC 2012-01-03 US disclosed
US-20110178315-A1 PROCESS FOR THE CONVERSION OF A CRUDE GLYCEROL, CRUDE MIXTURES OF NATURALLY DERIVED MULTICOMPONENT ALIPHATIC HYDROCARBONS OR ESTERS THEREOF TO A CHLOROHYDRIN DOW GLOBAL TECHNOLOGIES LLC (US) 2011-07-21 US disclosed
US-20110124890-A1 BATCH, SEMI-CONTINUOUS OR CONTINUOUS HYDROCHLORINATIONOF GLYCERIN WITH REDUCED VOLATILE CHLORINATED HYDROCARBON BY-PRODUCTS AND CHLOROACETONE LEVELS BLUE CUBE IP LLC 2011-05-26 US disclosed
US-20110124892-A1 BATCH, SEMI-CONTINUOUS OR CONTINUOUS HYDROCHLORINATIONOF GLYCERIN WITH REDUCED VOLATILE CHLORINATED HYDROCARBON BY-PRODUCTS AND CHLOROACETONE LEVELS BLUE CUBE IP LLC 2011-05-26 US disclosed
US-7910781-B2 Process for the conversion of a crude glycerol, crude mixtures of naturally derived multihydroxylated aliphatic hydrocarbons or esters thereof to a chlorohydrin DOW GLOBAL TECHNOLOGIES LLC 2011-03-22 US disclosed
US-7906690-B2 Batch, semi-continuous or continuous hydrochlorination of glycerin with reduced volatile chlorinated hydrocarbon by-products and chloracetone levels DOW GLOBAL TECHNOLOGIES INC. 2011-03-15 US disclosed
EP-2181979-A1 Conversion of a multihydroxylated aliphatic hydrocarbon or ester thereof to a chlorohydrin Dow Global Technologies Inc. (US) 2010-05-05 EP disclosed
EP-2174925-A1 Conversion of a multihydroxylated-aliphatic hydrocarbon or ester thereof to a chlorohydrin Dow Global Technologies Inc. (US) 2010-04-14 EP disclosed
EP-1771403-B1 CONVERSION OF A MULTIHYDROXYLATED-ALIPHATIC HYDROCARBON OR ESTER THEREOF TO A CHLOROHYDRIN DOW GLOBAL TECHNOLOGIES INC (US) 2010-01-06 EP disclosed
US-20080045728-A1 Conversion of a Multihydroxylated-Aliphatic Hydrocarbon or Ester Thereof to a Chlorohydrin BLUE CUBE IP LLC 2008-02-21 US disclosed
US-20080015370-A1 Process for the conversion of a crude glycerol, crude mixtures of naturally derived multicomponent aliphatic hydrocarbons or esters thereof to a chlorohydrin BLUE CUBE IP LLC 2008-01-17 US disclosed
US-20080015369-A1 Batch, semi-continuous or continuous hydrochlorination of glycerin with reduced volatile chlorinated hydrocarbon by-products and chloracetone levels BLUE CUBE IP LLC 2008-01-17 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 (6 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-20110124892-A1 BATCH, SEMI-CONTINUOUS OR CONTINUOUS HYDROCHLORINATIONOF GLYCERIN WITH REDUCED VOLATILE CHLORINATED HYDROCARBON BY-PRODUCTS AND CHLOROACETONE LEVELS GK, CHLSN, GLI2 TSHR 3840/4885CHRM2 1756/4885CHRM4 1942/4885
US-20080015370-A1 Process for the conversion of a crude glycerol, crude mixtures of naturally derived multicomponent aliphatic hydrocarbons or esters thereof to a chlorohydrin GK, CETP, CYP46A1 TSHR 4840/4885CHRM2 2976/4885CHRM4 3103/4885
US-20080045728-A1 Conversion of a Multihydroxylated-Aliphatic Hydrocarbon or Ester Thereof to a Chlorohydrin CHN2, HDHD5, ASPH TSHR 4760/4885CHRM2 3713/4885CHRM4 3607/4885
US-20110178315-A1 PROCESS FOR THE CONVERSION OF A CRUDE GLYCEROL, CRUDE MIXTURES OF NATURALLY DERIVED MULTICOMPONENT ALIPHATIC HYDROCARBONS OR ESTERS THEREOF TO A CHLOROHYDRIN GK, CETP, CYP46A1 TSHR 4840/4885CHRM2 2976/4885CHRM4 3103/4885
US-20110124890-A1 BATCH, SEMI-CONTINUOUS OR CONTINUOUS HYDROCHLORINATIONOF GLYCERIN WITH REDUCED VOLATILE CHLORINATED HYDROCARBON BY-PRODUCTS AND CHLOROACETONE LEVELS GK, CHLSN, GLI2 TSHR 3840/4885CHRM2 1756/4885CHRM4 1942/4885
US-20080015369-A1 Batch, semi-continuous or continuous hydrochlorination of glycerin with reduced volatile chlorinated hydrocarbon by-products and chloracetone levels GK, GLI2, CHLSN TSHR 3067/4885CHRM2 992/4885CHRM4 1321/4885

“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.