SCHEMBL5487618

SCHEMBL5487618

CCOC(=O)C(CN(C)C)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.52
MMP8 P22894 1/20 0.50
GAA P10253 1/20 0.49
HTR2A P28223 1/20 0.48
HRH1 P35367 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 2/20 0.47
PIN1 Q13526 1/20 0.46
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44

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
SCHEMBL10574539 0.84 CHRM1 (0.57) CHRM1MMP8GAAHTR2AHRH1
SCHEMBL1069511 0.84 LMNA (0.60) ALDH1A1
SCHEMBL6667892 0.83 ALDH1A1 (0.50) GAAHTR2AHRH1MEN1KMT2A
SCHEMBL805646 0.82 GAA (0.62) MMP8GAATDP1KDM4EPIN1
SCHEMBL260296 0.82 GAA (0.62) MMP8GAATDP1KDM4EPIN1
SCHEMBL23027214 0.82 GAA (0.62) MMP8GAATDP1KDM4EPIN1
SCHEMBL5972492 0.82 MMP8 (0.56) CHRM1MMP8GAATDP1KDM4E
SCHEMBL22304944 0.81 ALDH1A1 (0.52) CHRM1GAAHTR2AHRH1TDP1
SCHEMBL10573994 0.81 CHRM1 (0.55) CHRM1MMP8GAAHTR2AHRH1
SCHEMBL363236 0.81 LTA4H (0.50) CHRM1MMP8GAAKDM4EKMT2A

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
US-7273947-B1 Method for reducing 3-dimethylamnio-2-phenylpropion-acid ethyl ester-content in solutions of 2-dimethylamino-1-phenyl-3-cyclohexene-1-carboxylic acid ethyl ester BASF AKTIENGESELLSCHAFT (DE) 2007-09-25 US claimed
EP-1144361-B1 METHOD FOR REDUCING 3-DIMETHYLAMINO-2-PHENYLPROPION-ACID ETHYL ESTER-CONTENT IN SOLUTIONS OF 2-DIMETHYLAMINO-1-PHENYL-3-CYCLOHEXENE-1-CARBOXYLIC ACID ETHYL ESTER BASF AG (DE) 2004-08-18 EP claimed
US-7273947-B1 Method for reducing 3-dimethylamnio-2-phenylpropion-acid ethyl ester-content in solutions of 2-dimethylamino-1-phenyl-3-cyclohexene-1-carboxylic acid ethyl ester BASF AKTIENGESELLSCHAFT (DE) 2007-09-25 US disclosed
US-7273947-B1 Method for reducing 3-dimethylamnio-2-phenylpropion-acid ethyl ester-content in solutions of 2-dimethylamino-1-phenyl-3-cyclohexene-1-carboxylic acid ethyl ester BASF AKTIENGESELLSCHAFT (DE) 2007-09-25 US disclosed
US-7273947-B1 Method for reducing 3-dimethylamnio-2-phenylpropion-acid ethyl ester-content in solutions of 2-dimethylamino-1-phenyl-3-cyclohexene-1-carboxylic acid ethyl ester BASF AKTIENGESELLSCHAFT (DE) 2007-09-25 US disclosed
US-7273947-B1 Method for reducing 3-dimethylamnio-2-phenylpropion-acid ethyl ester-content in solutions of 2-dimethylamino-1-phenyl-3-cyclohexene-1-carboxylic acid ethyl ester BASF AKTIENGESELLSCHAFT (DE) 2007-09-25 US disclosed
CN-1177805-C Method for reducing 2-dimethylamino-2-phenylpropion-acid ethyl ester content in solutions of 2-dimethylamino-1-phenyl-3-cyclohexene-1-carboxylic acid ethyl ester 2004-12-01 CN disclosed
CN-1177805-C Method for reducing 2-dimethylamino-2-phenylpropion-acid ethyl ester content in solutions of 2-dimethylamino-1-phenyl-3-cyclohexene-1-carboxylic acid ethyl ester 2004-12-01 CN disclosed
EP-1144361-B1 METHOD FOR REDUCING 3-DIMETHYLAMINO-2-PHENYLPROPION-ACID ETHYL ESTER-CONTENT IN SOLUTIONS OF 2-DIMETHYLAMINO-1-PHENYL-3-CYCLOHEXENE-1-CARBOXYLIC ACID ETHYL ESTER BASF AG (DE) 2004-08-18 EP disclosed
EP-1144361-B1 METHOD FOR REDUCING 3-DIMETHYLAMINO-2-PHENYLPROPION-ACID ETHYL ESTER-CONTENT IN SOLUTIONS OF 2-DIMETHYLAMINO-1-PHENYL-3-CYCLOHEXENE-1-CARBOXYLIC ACID ETHYL ESTER BASF AG (DE) 2004-08-18 EP disclosed
CN-1373746-A Method for reducing 2-dimethylamino-2-phenylpropion-acid ethyl ester content in solutions of 2-dimethylamino-1-phenyl-3-cyclohexene-1-carboxylic acid ethyl ester KNOLL AG (DE) 2002-10-09 CN disclosed
CN-1373746-A Method for reducing 2-dimethylamino-2-phenylpropion-acid ethyl ester content in solutions of 2-dimethylamino-1-phenyl-3-cyclohexene-1-carboxylic acid ethyl ester KNOLL AG (DE) 2002-10-09 CN disclosed
EP-1144361-A1 METHOD FOR REDUCING 3-DIMETHYLAMINO-2-PHENYLPROPION-ACID ETHYL ESTER-CONTENT IN SOLUTIONS OF 2-DIMETHYLAMINO-1-PHENYL-3-CYCLOHEXENE-1-CARBOXYLIC ACID ETHYL ESTER KNOLL AKTIENGESELLSCHAFT (DE) 2001-10-17 EP disclosed
EP-1144361-A1 METHOD FOR REDUCING 3-DIMETHYLAMINO-2-PHENYLPROPION-ACID ETHYL ESTER-CONTENT IN SOLUTIONS OF 2-DIMETHYLAMINO-1-PHENYL-3-CYCLOHEXENE-1-CARBOXYLIC ACID ETHYL ESTER KNOLL AKTIENGESELLSCHAFT (DE) 2001-10-17 EP disclosed
WO-2000043353-A1 METHOD FOR REDUCING 3-DIMETHYLAMINO-2-PHENYLPROPION-ACID ETHYL ESTER-CONTENT IN SOLUTIONS OF 2-DIMETHYLAMINO-1-PHENYL-3-CYCLOHEXENE-1-CARBOXYLIC ACID ETHYL ESTER KNOLL AKTIENGESELLSCHAFT (DE) 2000-07-27 WO disclosed
WO-2000043353-A1 METHOD FOR REDUCING 3-DIMETHYLAMINO-2-PHENYLPROPION-ACID ETHYL ESTER-CONTENT IN SOLUTIONS OF 2-DIMETHYLAMINO-1-PHENYL-3-CYCLOHEXENE-1-CARBOXYLIC ACID ETHYL ESTER KNOLL AKTIENGESELLSCHAFT (DE) 2000-07-27 WO disclosed