SCHEMBL2049258

SCHEMBL2049258

CCOC(=O)C(=CO)C(=O)OCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.60
GLO1 Q04760 1/20 0.60
ALDH1A1 P00352 4/20 0.52
CYP2D6 P10635 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
LMNA P02545 4/20 0.46
MAPT P10636 4/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
S1PR4 O95977 1/20 0.46
S1PR1 P21453 1/20 0.46
MAPK1 P28482 1/20 0.46
DHODH Q02127 2/20 0.44
HSD17B10 Q99714 1/20 0.43
GAA P10253 3/20 0.42
ALOX15 P16050 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL10826503 0.97 NPSR1 (0.58) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL27955481 0.97 NPSR1 (0.58) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL14390126 0.88 GLO1 (0.72) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL8832385 0.88 NPSR1 (0.54) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL14518032 0.88 NPSR1 (0.54) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL2049259 0.88 NPSR1 (0.54) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL14261596 0.88 GLO1 (0.72) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL13304509 0.88 NPSR1 (0.54) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL10780939 0.86 NPSR1 (0.52) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL1942274 0.81 NPSR1 (0.62) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105272964-B The 6 substitution Ethyl formate class compounds of 1 ((base of 1 substituted-phenyl, 1,2,3 triazole 4) methyl) 4 carbonyl quinoline 3 and its preparation and application 河南省医药科学研究院 2017-11-24 CN claimed
CN-105237512-B The 6 substitution formic acid of 1 ((base of 1 substituted-phenyl, 1,2,3 triazole 4) methyl) 4 carbonyl quinoline 3 or pharmaceutical salts, preparation and application 河南省医药科学研究院 2017-08-18 CN claimed
EP-0376870-A1 A new organosilylpolyphosphoric reagent, its preparation and application to the process of synthesis of 3-carboxyquinolones or azaquinolones and their salts CENTRO MARGA PARA LA INVESTIGACION S.A. (ES) 1990-07-04 EP claimed
US-9065900-B2 Method and system to shield mobile phones and devices to minimize radiation exposure GREEN SWAN, INC. (US) 2015-06-23 US disclosed
US-20110157859-A1 METHOD AND SYSTEM TO SHIELD MOBILE PHONES AND DEVICES TO MINIMIZE RADIATION EXPOSURE GREEN SWAN, INC. 2011-06-30 US disclosed
WO-2010038165-A1 IMIDAZO[1,5]NAPHTHYRIDINE COMPOUNDS, THEIR PHARMACEUTICAL USE AND COMPOSITIONS PFIZER INC. (US) 2010-04-08 WO disclosed
WO-2009108838-A1 BRIDGED, BICYCLIC HETEROCYCLIC OR SPIRO BICYCLIC HETEROCYCLIC DERIVATIVES OF PYRAZOLO[1,5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-03 WO disclosed
US-7335466-B2 Silver salt photothermographic dry imaging material, image recording method and image forming method for the same KONICA MINOLTA HOLDINGS, INC. (JP) 2008-02-26 US disclosed
US-7335466-B2 Silver salt photothermographic dry imaging material, image recording method and image forming method for the same KONICA MINOLTA HOLDINGS, INC. (JP) 2008-02-26 US disclosed
US-7267935-B1 Thermally developable materials stabilized with crown ethers CARESTREAM HEALTH, INC. (US) 2007-09-11 US disclosed
US-7267935-B1 Thermally developable materials stabilized with crown ethers CARESTREAM HEALTH, INC. (US) 2007-09-11 US disclosed
EP-1682532-B1 PYRIMIDINES AS INHIBITORS OF PHOSPHOINOSITIDE-3-KINASES (PI3K) WARNER LAMBERT CO (US) 2007-06-27 EP disclosed
US-7202019-B2 Photothermographic imaging material KONICA MINOLTA HOLDINGS, INC. (JP) 2007-04-10 US disclosed
US-7202019-B2 Photothermographic imaging material KONICA MINOLTA HOLDINGS, INC. (JP) 2007-04-10 US disclosed
WO-2007014925-A1 MACROCYLIC INHIBITORS OF HEPATITIS C VIRUS TIBOTEC PHARMACEUTICALS LTD. (IE) 2007-02-08 WO disclosed
US-7163782-B2 Photothermographic imaging material KONICA MINOLTA HOLDINGS, INC. (JP) 2007-01-16 US disclosed
US-7163782-B2 Photothermographic imaging material KONICA MINOLTA HOLDINGS, INC. (JP) 2007-01-16 US disclosed
EP-0376870-A1 A new organosilylpolyphosphoric reagent, its preparation and application to the process of synthesis of 3-carboxyquinolones or azaquinolones and their salts CENTRO MARGA PARA LA INVESTIGACION S.A. (ES) 1990-07-04 EP disclosed
US-4600781-A 2-formyl-2-halomalonates and compound derived therefrom THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1986-07-15 US disclosed