SCHEMBL2077620

SCHEMBL2077620

CCCCCCCC(=O)OCC.CCN(C(C)C)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.56
DGKA P23743 1/20 0.55
LMNA P02545 4/20 0.51
PAM P19021 2/20 0.50
DNM1 Q05193 1/20 0.50
ALDH1A1 P00352 1/20 0.50
KDM4E B2RXH2 1/20 0.49
DUSP3 P51452 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TSHR P16473 1/20 0.47
PRKCA P17252 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKCQ Q04759 1/20 0.46
PRKCD Q05655 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL3416150 0.86 LMNA (0.55) MAPTDGKALMNAPAMDNM1
Isopropyl Alcohol SCHEMBL6139772 0.84 MAPT (0.70) MAPTDGKALMNAPAMDNM1
Isopropyl Alcohol SCHEMBL18584855 0.84 MAPT (0.70) MAPTDGKALMNAPAMDNM1
SCHEMBL8375548 0.84 DGKA (0.75) MAPTDGKALMNAPAMDNM1
Hexane SCHEMBL3151787 0.84 DGKA (0.75) MAPTDGKALMNAPAMDNM1
Hexane SCHEMBL2349171 0.84 DGKA (0.75) MAPTDGKALMNAPAMDNM1
SCHEMBL116995 0.84 DGKA (0.75) MAPTDGKALMNAPAMDNM1
SCHEMBL454 0.84 DGKA (0.75) MAPTDGKALMNAPAMDNM1
SCHEMBL5448566 0.84 DGKA (0.75) MAPTDGKALMNAPAMDNM1
SCHEMBL11527039 0.84 DGKA (0.75) MAPTDGKALMNAPAMDNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877750-B2 2-oxy-benzoxazinone derivatives for the treatment of obesity NORGINE B.V. (NL) 2014-11-04 US disclosed
EP-1143977-B3 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY NORGINE BV (NL) 2012-10-24 EP disclosed
CN-1915981-B 2-oxy-benzoxazinone derivatives for the treatment of obesity NORGINE BV 2011-09-28 CN disclosed
US-20110065697-A1 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY NORGINE B.V. (NL) 2011-03-17 US disclosed
US-7858617-B2 2-hexadecyloxy-6-methyl-4H-3,1-benzoxazin-4-one; inhibition of a lipase, esterase or phosphatase enzyme NORGINE B.V. (NL) 2010-12-28 US disclosed
US-7825113-B2 An enzyme inhibitors, enzyme is to catalyse the hydrolysis of an ester; treating hyperlipaemia, hyperglycaemia (type II diabetes), hypertension, cardiovascular disorders stroke, gastrointestinal disease; chemical intermediate synthesis NORGINE B.V. (NL) 2010-11-02 US disclosed
US-20080161301-A1 2-hexadecyloxy-6-methyl-4H-3,1-benzoxazin-4-one; inhibition of a lipase, esterase or phosphatase enzyme ALIZYME THERAPEUTICS LIMITED (GB) 2008-07-03 US disclosed
CN-1315813-C 2-oxo-4H-3, 1-benzoxazin-4-ones for the treatment of obesity ALIZYME THERAPEUTICS LTD (GB) 2007-05-16 CN disclosed
CN-1915981-A 2-oxy-benzoxazinone derivatives for the treatment of obesity ALIZYME THERAPEUTICS LTD (GB) 2007-02-21 CN disclosed
EP-1143977-B1 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY ALIZYME THERAPEUTICS LTD (GB) 2005-04-20 EP disclosed
US-20030195206-A1 An enzyme inhibitors, enzyme is to catalyse the hydrolysis of an ester; treating hyperlipaemia, hyperglycaemia (type II diabetes), hypertension, cardiovascular disorders stroke, gastrointestinal disease; chemical intermediate synthesis NORGINE B.V. (NL) 2003-10-16 US disclosed
US-6624161-B2 Administering 2-oxy substituted benzoxazin-5-one derivative to a human or animal for the prevention or treatment of obesity or an obesity related disorder ALIZYME THERAPEUTICS LIMITED (GB) 2003-09-23 US disclosed
US-20030027821-A1 Administering 2-oxy substituted benzoxazin-5-one derivative to a human or animal for the prevention or treatment of obesity or an obesity related disorder NORGINE B.V. (NL) 2003-02-06 US disclosed
WO-2000040247-A9 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY ALIZYME THERAPEUTICS LTD (GB) 2002-10-24 WO disclosed
CN-1359378-A 2-oxo-4H-3, 1-benzoxazine 4-ones for the treatment of obesity ALIZYME THERAPEUTICS LTD (GB) 2002-07-17 CN disclosed
EP-1144395-A1 2-AMINO-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY Alizyme Therapeutics Limited (GB) 2001-10-17 EP disclosed
WO-2000040569-A1 2-AMINO-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY ALIZYME THERAPEUTICS LIMITED (GB) 2000-07-13 WO 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 (4 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-20080161301-A1 2-hexadecyloxy-6-methyl-4H-3,1-benzoxazin-4-one; inhibition of a lipase, esterase or phosphatase enzyme LPL, LIPE, PNLIP MAPT 4706/4885DGKA 1017/4885LMNA 2014/4885
US-20110065697-A1 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY CYP1B1, CYP4X1, ACOX1 MAPT 4757/4885DGKA 2063/4885LMNA 1990/4885
US-20030027821-A1 Administering 2-oxy substituted benzoxazin-5-one derivative to a human or animal for the prevention or treatment of obesity or an obesity related disorder CYP2F1, BBOX1, CES1 MAPT 4061/4885DGKA 2985/4885LMNA 1592/4885
US-20030195206-A1 An enzyme inhibitors, enzyme is to catalyse the hydrolysis of an ester; treating hyperlipaemia, hyperglycaemia (type II diabetes), hypertension, cardiovascular disorders stroke, gastrointestinal disease; chemical intermediate synthesis CES1, LIPC, PNLIP MAPT 2799/4885DGKA 1063/4885LMNA 1584/4885

“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.