Phenylglyoxal

Phenylglyoxal

SCHEMBL8918694

CCOC(C)OCC.O=CC(=O)c1ccccc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.60
ALDH1A1 P00352 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
KMT2A Q03164 4/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
MAPT P10636 2/20 0.43
AKT1 P31749 3/20 0.42
MEN1 O00255 3/20 0.41
PKM P14618 1/20 0.40
LMNA P02545 2/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
PGR P06401 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
KCNH2 Q12809 1/20 0.40
CES2 O00748 1/20 0.40

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
Phenylglyoxal SCHEMBL9065567 0.97 MAPK1 (0.56) MAPK1ALDH1A1TDP1KMT2ANPC1
SCHEMBL9302736 0.85 CA12 (0.46) MAPK1ALDH1A1TDP1KMT2ARAB9A
Phenylglyoxal SCHEMBL8060257 0.82 MAPK1 (0.69) MAPK1ALDH1A1TDP1KMT2ANPC1
Benzil SCHEMBL1923895 0.82 CES2 (0.54) ALDH1A1KMT2ANPC1RAB9AMAPT
Acetophenone SCHEMBL6684394 0.81 LMNA (0.47) ALDH1A1KMT2ANPC1RAB9AMAPT
Phenylglyoxal SCHEMBL8924305 0.81 TDP1 (0.67) MAPK1ALDH1A1TDP1KMT2ANPC1
Benzil SCHEMBL1230822 0.79 CES2 (0.50) ALDH1A1KMT2ANPC1RAB9AMAPT
Acetophenone SCHEMBL9049185 0.78 LMNA (0.44) ALDH1A1KMT2ANPC1MAPTMEN1
Acetophenone SCHEMBL9387329 0.78 CES2 (0.44) ALDH1A1KMT2ANPC1MAPTMEN1
Benzil SCHEMBL10419472 0.78 CES2 (0.49) ALDH1A1KMT2ANPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5319142-A Process for preparing substituted and unsubstituted arylalkylamines HOECHST CELANESE CORPORATION (US) 1994-06-07 US claimed
US-5124489-A Process for preparing phenethanol ethers by the reduction of corresponding phenylglyoxal acetals HOECHST CELANESE CORPORATION (US) 1992-06-23 US claimed
US-5602285-A ETHERIFICATION OF PHENETHYL ALCOHOL WITH PRIMARY ALIPHATIC ALCOHOL IN PRESENCE OF ACID CATALYST HOECHST CELANESE CORP. (US) 1997-02-11 US disclosed
WO-1996035829-A1 PROCESS FOR THE ELECTROCHEMICAL OXIDATION OF ARYLKETONES HOECHST CELANESE CORPORATION (US) 1996-11-14 WO disclosed
US-5567299-A Process for the electrochemical oxidation of arylketones HOECHST CELANESE CORPORATION (US) 1996-10-22 US disclosed
EP-0705239-A4 PROCESS FOR PREPARING PHENETHANOL ETHERS HOECHST CELANESE CORP (US) 1996-08-21 EP disclosed
CN-1125934-A Process for preparing phenethanol ethers HOECHST CELANESE CORP (US) 1996-07-03 CN disclosed
EP-0705239-A1 PROCESS FOR PREPARING PHENETHANOL ETHERS HOECHST CELANESE CORPORATION (US) 1996-04-10 EP disclosed
US-5500099-A Process for the electrochemical oxidation of arylketones HOECHST CELANESE CORPORATION (US) 1996-03-19 US disclosed
US-5466873-A Reacting acetophenone with nitrosonium compound in presence of water and acid to make phenylglyoxal HOECHST CELANESE CORPORATION (US) 1995-11-14 US disclosed
US-5457231-A Reacting arylisonitrosoalkanones with hydrogen in presence of supported transition metal catalyst and liquid carboxylic acid HOECHST CELANESE CORPORATION (US) 1995-10-10 US disclosed
WO-1995000467-A1 PROCESS FOR PREPARING PHENETHANOL ETHERS HOECHST CELANESE CORPORATION (US) 1995-01-05 WO disclosed
US-5349090-A Process for preparing arylketoamines HOECHST CELANESE CORPORATION (US) 1994-09-20 US disclosed
US-5319142-A Process for preparing substituted and unsubstituted arylalkylamines HOECHST CELANESE CORPORATION (US) 1994-06-07 US disclosed
US-5319142-A Process for preparing substituted and unsubstituted arylalkylamines HOECHST CELANESE CORPORATION (US) 1994-06-07 US disclosed
WO-1993017989-A1 PREPARATION OF SUBSTITUTED OR UNSUBSTITUTED PHENYLGLYOXALS HOECHST CELANESE CORPORATION (US) 1993-09-16 WO disclosed
US-5124489-A Process for preparing phenethanol ethers by the reduction of corresponding phenylglyoxal acetals HOECHST CELANESE CORPORATION (US) 1992-06-23 US disclosed
US-5124489-A Process for preparing phenethanol ethers by the reduction of corresponding phenylglyoxal acetals HOECHST CELANESE CORPORATION (US) 1992-06-23 US disclosed
US-5124489-A Process for preparing phenethanol ethers by the reduction of corresponding phenylglyoxal acetals HOECHST CELANESE CORPORATION (US) 1992-06-23 US disclosed
US-4895586-A PLANT GROWTH REGULATORS BASF AKTIENGESELLSCHAFT (DE) 1990-01-23 US disclosed