SCHEMBL4649609

SCHEMBL4649609

CC(=O)N(C)C(C)C(O)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.66
KDM4E B2RXH2 2/20 0.63
ALDH1A1 P00352 1/20 0.63
AOC3 Q16853 1/20 0.59
NPY5R Q15761 12/20 0.57
NPY2R P49146 1/20 0.55
ADRA2A P08913 1/20 0.47
ADRA2C P18825 1/20 0.47
LMNA P02545 1/20 0.47
HIF1A Q16665 1/20 0.47

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
SCHEMBL14008046 1.00 GAA (0.66) GAAKDM4EALDH1A1AOC3NPY5R
SCHEMBL16901643 1.00 GAA (0.66) GAAKDM4EALDH1A1AOC3NPY5R
SCHEMBL14008045 1.00 GAA (0.66) GAAKDM4EALDH1A1AOC3NPY5R
SCHEMBL14393866 1.00 GAA (0.66) GAAKDM4EALDH1A1AOC3NPY5R
SCHEMBL14393690 1.00 GAA (0.66) GAAKDM4EALDH1A1AOC3NPY5R
SCHEMBL14197120 0.84 GAA (0.64) GAAKDM4EALDH1A1AOC3NPY5R
SCHEMBL14338232 0.84 GAA (0.64) GAAKDM4EALDH1A1AOC3NPY5R
SCHEMBL14368075 0.84 GAA (0.64) GAAKDM4EALDH1A1AOC3NPY5R
SCHEMBL14338233 0.84 GAA (0.64) GAAKDM4EALDH1A1AOC3NPY5R
Methylephedrine SCHEMBL11356628 0.83 KDM4E (0.85) GAAKDM4EALDH1A1AOC3NPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102584620-B The preparation method of alpha-amino ketone derivative SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2015-09-23 CN claimed
US-11857684-B2 Oral bilayer tablets comprising acetylsalicylic acid and pseudoephedrine, methods of preparing and using thereof BAYER HEALTHCARE LLC (US) 2024-01-02 US disclosed
US-11857684-B2 Oral bilayer tablets comprising acetylsalicylic acid and pseudoephedrine, methods of preparing and using thereof BAYER HEALTHCARE LLC (US) 2024-01-02 US disclosed
US-20220151936-A1 ORAL BILAYER TABLETS COMPRISING ACETYLSALICYLIC ACID AND PSEUDOEPHEDRINE, METHODS OF PREPARING AND USING THEREOF BAYER HEALTHCARE LLC (US) 2022-05-19 US disclosed
WO-2022103620-A1 ORAL BILAYER TABLETS COMPRISING ACETYLSALICYLIC ACID AND PSEUDOEPHEDRINE, METHODS OF PREPARING AND USING THEREOF BAYER HEALTHCARE LLC (US) 2022-05-19 WO disclosed
CN-102584620-B The preparation method of alpha-amino ketone derivative SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2015-09-23 CN disclosed
CN-102584620-A Preparation method for alpha-amino ketone derivative SHANGHAI INST PHARM INDUSTRY 2012-07-18 CN disclosed
US-20080293971-A1 A Process for the Preparation of R-(-)-N, Alpha-Dimethylphenethylamine (Levmethamfetamine) or S-(+)-N, Alpha-Dimethylphenethylamine (Methamphetamine) from D-Ephendrine, or L-Ephedrine Respectively EMMELLEN BIOTECH PHARMACEUTICALS LIMITED (IN) 2008-11-27 US disclosed
EP-1828105-B1 A PROCESS FOR THE PREPARATION OF R-(-)-N, ALPHA-DIMETHYLPHENETHYLAMINE (LEVMETAMFETAMINE) OR S-(+)-N, ALPHA-DIMETHYLPHENETHYLAMINE (METHAMPHETAMINE) FROM d-EPHEDRINE OR L-EPHEDRINE RESPECTIVELY EMMELLEN BIOTECH PHARMACEUTICA (IN) 2008-09-03 EP disclosed
EP-1828105-A1 A PROCESS FOR THE PREPARATION OF R-(-)-N, ALPHA-DIMETHYLPHENETHYLAMINE (LEVMETAMFETAMINE) OR S-(+)-N, ALPHA-DIMETHYLPHENETHYLAMINE (METHAMPHETAMINE) FROM d-EPHEDRINE OR L-EPHEDRINE RESPECTIVELY Emmellen Biotech Pharmaceuticals Limited (IN) 2007-09-05 EP disclosed
US-5750520-A SELECTIVE THROMBIN INHIBITORS; WOUND HEALING AGENTS PFIZER INC. (US) 1998-05-12 US disclosed
EP-0822934-A1 ANTITHROMBOTIC AMIDINOTETRAHYDROPYRIDYLALANINE DERIVATIVES Pfizer Research and Development Company, N.V./S.A. (IE) 1998-02-11 EP disclosed
EP-0728132-B1 ANTITHROMBOTIC AMIDINOPHENYLALANINE AND AMIDINOPYRIDYLALANINE DERIVATIVES PFIZER LTD (GB) 1997-07-16 EP disclosed
WO-1996033993-A1 ANTITHROMBOTIC AMIDINOTETRAHYDROPYRIDYLALANINE DERIVATIVES PFIZER RESEARCH AND DEVELOPMENT COMPANY, N.V./S.A. (IE) 1996-10-31 WO disclosed
EP-0728132-A1 ANTITHROMBOTIC AMIDINOPHENYLALANINE AND AMIDINOPYRIDYLALANINE DERIVATIVES PFIZER LTD (GB) 1996-08-28 EP disclosed
WO-1995013274-A1 ANTITHROMBOTIC AMIDINOPHENYLALANINE AND AMIDINOPYRIDYLALANINE DERIVATIVES PFIZER LIMITED (GB) 1995-05-18 WO disclosed
US-5192800-A Hypotensive agents PFIZER INC. (US) 1993-03-09 US disclosed
EP-0342850-B1 ENANTIOMERIC GLUTARAMIDE DIURETIC AGENTS Pfizer Limited (GB) 1992-05-20 EP disclosed
US-5030654-A Glutaramide diuretic agents PFIZER INC. (US) 1991-07-09 US disclosed
EP-0342850-A1 Enantiomeric glutaramide diuretic agents Pfizer Limited (GB) 1989-11-23 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 (3 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-20220151936-A1 ORAL BILAYER TABLETS COMPRISING ACETYLSALICYLIC ACID AND PSEUDOEPHEDRINE, METHODS OF PREPARING AND USING THEREOF PTGDR, PLA2G7, PTGIR GAA 1463/4885KDM4E 3249/4885ALDH1A1 3274/4885
US-20080293971-A1 A Process for the Preparation of R-(-)-N, Alpha-Dimethylphenethylamine (Levmethamfetamine) or S-(+)-N, Alpha-Dimethylphenethylamine (Methamphetamine) from D-Ephendrine, or L-Ephedrine Respectively HNMT, DDT, METTL3 GAA 1497/4885KDM4E 501/4885ALDH1A1 252/4885
US-11857684-B2 Oral bilayer tablets comprising acetylsalicylic acid and pseudoephedrine, methods of preparing and using thereof PTGDR, PLA2G7, PTGIR GAA 1463/4885KDM4E 3249/4885ALDH1A1 3274/4885

“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.