SCHEMBL5597933

SCHEMBL5597933

N#CC(=O)c1ccccc1CCl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.36
TSHR P16473 3/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 2/20 0.36
FOLH1 Q04609 1/20 0.35
KMT2A Q03164 2/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
ALOX15 P16050 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 2/20 0.33
HPGD P15428 2/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSP90AA1 P07900 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL11473722 0.82 CLCN2 (0.41) ALDH1A1TSHRMAPTFOLH1KMT2A
SCHEMBL8116752 0.81 CYP1A1 (0.36) ALDH1A1TSHRMAPTKDM4EFOLH1
SCHEMBL11388477 0.81 ALDH1A1 (0.44) ALDH1A1TSHRMAPTKDM4EFOLH1
SCHEMBL9579734 0.81 FOLH1 (0.35) ALDH1A1TSHRMAPTKDM4EFOLH1
SCHEMBL8517295 0.79 ALDH1A1 (0.46) ALDH1A1TSHRMAPTKDM4EKMT2A
Acetonitrile SCHEMBL27860599 0.78 FOLH1 (0.49) ALDH1A1TSHRKDM4EFOLH1ALOX15
Water SCHEMBL28844415 0.78 FOLH1 (0.57) ALDH1A1TSHRMAPTKDM4EFOLH1
SCHEMBL3145510 0.77 ALDH1A1 (0.42) ALDH1A1TSHRMAPTFOLH1CES2
SCHEMBL8746151 0.77 ALDH1A1 (0.33) ALDH1A1TSHRKDM4ETRPA1CYP1A1
SCHEMBL152624 0.75 ALDH1A1 (0.50) ALDH1A1TSHRFOLH1CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874807-B1 PROCESS FOR THE PREPARATION OF METHOXYMINOPHENYLGLYOXYLIC ACID DERIVATIVES BAYER AG (DE) 2002-02-20 EP claimed
EP-0874807-A1 PROCESS FOR THE PREPARATION OF METHOXYMINOPHENYLGLYOXYLIC ACID DERIVATIVES Novartis AG (CH) 1998-11-04 EP claimed
WO-1997019912-A1 PROCESS FOR THE PREPARATION OF METHOXYMINOPHENYLGLYOXYLIC ACID DERIVATIVES NOVARTIS AG (CH) 1997-06-05 WO claimed
JP-11228518-A None JP disclosed
CN-112409207-B Preparation method of dimoxystrobin 新发药业有限公司 2022-11-22 CN disclosed
CN-112409207-A Preparation method of dimoxystrobin 新发药业有限公司 2021-02-26 CN disclosed
EP-0765304-B2 METHOD OF PREPARING ALPHA-METHOXYIMINOCARBOXYLIC ACID METHYLAMIDES, AND INTERMEDIATES USED IN THE METHOD BAYER CROPSCIENCE AG (DE) 2007-08-22 EP disclosed
EP-0874807-B2 PROCESS FOR THE PREPARATION OF METHOXYMINOPHENYLGLYOXYLIC ACID DERIVATIVES BAYER CROPSCIENCE AG (DE) 2006-08-02 EP disclosed
CN-1095830-C Process for preparing alkoxyiminoacetamide derivatives SHINOGI PHARMACEUTICAL CO LTD (JP) 2002-12-11 CN disclosed
CN-1082503-C Process for the preparation of methylamides of alpha-methoxyiminocarboxylic acids and intermediates therefor BASF AG (DE) 2002-04-10 CN disclosed
EP-0874807-B1 PROCESS FOR THE PREPARATION OF METHOXYMINOPHENYLGLYOXYLIC ACID DERIVATIVES BAYER AG (DE) 2002-02-20 EP disclosed
WO-1997019912-A1 PROCESS FOR THE PREPARATION OF METHOXYMINOPHENYLGLYOXYLIC ACID DERIVATIVES NOVARTIS AG (CH) 1997-06-05 WO disclosed
EP-0765304-A1 METHOD OF PREPARING ALPHA-METHOXYIMINOCARBOXYLIC ACID METHYLAMIDES, AND INTERMEDIATES USED IN THE METHOD BASF AKTIENGESELLSCHAFT (DE) 1997-04-02 EP disclosed
EP-0619300-B1 Process for the preparation of halogenmethylbenzoyl cyanides and halogenmethyl benzoylcyanides BASF AG (DE) 1996-12-27 EP disclosed
WO-1996016023-A1 PROCESS FOR PREPARING HALOGENATED METHYL BENZOYL CYANIDES BASF AKTIENGESELLSCHAFT (DE) 1996-05-30 WO disclosed
US-5510528-A Preparation of halomethylbenzoly cyanides and novel halomethylbenzoyl cyanides BASF AKTIENGESELLSCHAFT (DE) 1996-04-23 US disclosed
WO-1995034526-A1 METHOD OF PREPARING α-METHOXYIMINOCARBOXYLIC ACID METHYLAMIDES, AND INTERMEDIATES USED IN THE METHOD BASF AKTIENGESELLSCHAFT (DE) 1995-12-21 WO disclosed
US-5446199-A Preparation of halomethylbenzoyl cyanides and novel halomethylbenzoyl cyanides BASF AKTIENGESELLSCHAFT (DE) 1995-08-29 US disclosed
CN-1097412-A Preparation of halomethylbenzoyl cyanides and novel halomethylbenzoyl cyanides BASF AG (DE) 1995-01-18 CN disclosed
EP-0619300-A2 Process for the preparation of halogenmethylbenzoyl cyanides and halogenmethyl benzoylcyanides BASF Aktiengesellschaft (DE) 1994-10-12 EP disclosed