SCHEMBL2287377

SCHEMBL2287377

CCCOCCOCCOCC(N)=O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.40
HSD17B10 Q99714 1/20 0.36
ALOX15 P16050 1/20 0.35
TSHR P16473 3/20 0.34
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 1/20 0.33
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
CYP3A4 P08684 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
EPHX2 P34913 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL23875143 1.00 CES2 (0.40) CES2HSD17B10ALOX15TSHRALDH1A1
SCHEMBL2293384 1.00 CES2 (0.40) CES2HSD17B10ALOX15TSHRALDH1A1
SCHEMBL25733878 1.00 CES2 (0.40) CES2HSD17B10ALOX15TSHRALDH1A1
SCHEMBL22266204 1.00 CES2 (0.40) CES2HSD17B10ALOX15TSHRALDH1A1
SCHEMBL2241590 0.95
SCHEMBL22266462 0.91 CES2 (0.47) CES2HSD17B10TSHRALDH1A1MEN1
SCHEMBL22325195 0.89 CES2 (0.36) CES2HSD17B10ALOX15TSHRALDH1A1
SCHEMBL6668639 0.89 CES2 (0.36) CES2HSD17B10ALOX15TSHRALDH1A1
SCHEMBL30661132 0.89 CES2 (0.36) CES2HSD17B10ALOX15TSHRALDH1A1
SCHEMBL6712841 0.89 CES2 (0.36) CES2HSD17B10ALOX15TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2183220-A1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY Dublin City University (IE) 2010-05-12 EP claimed
WO-2009024607-A1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY DUBLIN CITY UNIVERSITY (IE) 2009-02-26 WO claimed
WO-2023192578-A1 PROTEIN DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-10-05 WO disclosed
EP-3689868-B1 TETRAHYDRONAPHTHALENE AND TETRAHYDROISOQUINOLINE DERIVATIVES AS ESTROGEN RECEPTOR DEGRADERS ARVINAS OPERATIONS INC (US) 2023-09-27 EP disclosed
US-11028088-B2 Modulators of BTK proteolysis and methods of use YALE UNIVERSITY (US) 2021-06-08 US disclosed
US-20210139458-A1 TETRAHYDRONAPHTHALENE AND TETRAHYDROISOQUINOLINE DERIVATIVES AS ESTROGEN RECEPTOR DEGRADERS ARVINAS OPERATIONS, INC. 2021-05-13 US disclosed
US-10723717-B2 Compounds and methods for the targeted degradation of rapidly accelerated fibrosarcoma polypeptides ARVINAS OPERATIONS, INC. (US) 2020-07-28 US disclosed
US-20190276495-A1 EBOLA VIRUS VACCINE RIKEN (JP) 2019-09-12 US disclosed
US-20190276459-A1 MODULATORS OF BTK PROTEOLYSIS AND METHODS OF USE YALE UNIVERSITY 2019-09-12 US disclosed
EP-2183220-B1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY UNIV DUBLIN CITY (IE) 2016-11-09 EP disclosed
US-8541598-B2 Biodegradable solvents for the chemical industry DUBLIN CITY UNIVERSITY (IE) 2013-09-24 US disclosed
US-20110201824-A1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY DUBLIN CITY UNIVERSITY (IE) 2011-08-18 US disclosed
EP-2183220-A1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY Dublin City University (IE) 2010-05-12 EP disclosed
WO-2009024607-A1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY DUBLIN CITY UNIVERSITY (IE) 2009-02-26 WO disclosed
US-4386935-A Process for producing discharge reserve prints on textile materials with amino-azo-benzene dyes CASSELLA AKTIENGESELLSCHAFT (DE) 1983-06-07 US disclosed
EP-0051261-A1 Process for the production of discharge-resist prints on textile materials CASSELLA Aktiengesellschaft (DE) 1982-05-12 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 (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-20210139458-A1 TETRAHYDRONAPHTHALENE AND TETRAHYDROISOQUINOLINE DERIVATIVES AS ESTROGEN RECEPTOR DEGRADERS MDM2, CRBN, VHL CES2 2782/4885HSD17B10 1145/4885ALOX15 3863/4885
US-20190276495-A1 EBOLA VIRUS VACCINE MICA, IRF3, VIP CES2 4817/4885HSD17B10 4191/4885ALOX15 4021/4885
US-20110201824-A1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY TIMM9, B2M, TIMM44 CES2 1170/4885HSD17B10 1280/4885ALOX15 1401/4885
US-11028088-B2 Modulators of BTK proteolysis and methods of use BTK, CBL, CRBN CES2 2796/4885HSD17B10 4006/4885ALOX15 4216/4885
US-20190276459-A1 MODULATORS OF BTK PROTEOLYSIS AND METHODS OF USE BTK, CBL, CRBN CES2 2796/4885HSD17B10 4006/4885ALOX15 4216/4885
US-10723717-B2 Compounds and methods for the targeted degradation of rapidly accelerated fibrosarcoma polypeptides CRBN, ARAF, VHL CES2 3556/4885HSD17B10 3903/4885ALOX15 4067/4885

“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.