SCHEMBL2076733

SCHEMBL2076733

CCCCCCCCCCCCCCOc1nc2ccc(C)cc2c(=O)o1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 10/20 0.54
MAPT P10636 1/20 0.52
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
PTK2B Q14289 1/20 0.44
C1R P00736 1/20 0.43
TP53 P04637 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL2078098 1.00 ELANE (0.54) ELANEMAPTKDM4EALDH1A1MEN1
SCHEMBL2077529 1.00 ELANE (0.54) ELANEMAPTKDM4EALDH1A1MEN1
SCHEMBL2076590 1.00 ELANE (0.54) ELANEMAPTKDM4EALDH1A1MEN1
SCHEMBL2076594 1.00 ELANE (0.54) ELANEMAPTKDM4EALDH1A1MEN1
Cetilistat SCHEMBL367612 1.00 ELANE (0.54) ELANEMAPTKDM4EALDH1A1MEN1
Cetilistat SCHEMBL29352962 1.00 ELANE (0.54) ELANEMAPTKDM4EALDH1A1MEN1
SCHEMBL2076646 1.00 ELANE (0.54) ELANEMAPTKDM4EALDH1A1MEN1
SCHEMBL2078034 1.00 ELANE (0.54) ELANEMAPTKDM4EALDH1A1MEN1
SCHEMBL2078347 1.00 ELANE (0.54) ELANEMAPTKDM4EALDH1A1MEN1
SCHEMBL12778013 0.95 ELANE (0.59) ELANEMAPTKDM4EALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1143977-B3 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY NORGINE BV (NL) 2012-10-24 EP claimed
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 claimed
EP-1143977-B1 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY ALIZYME THERAPEUTICS LTD (GB) 2005-04-20 EP claimed
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 claimed
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 claimed
US-20030138396-A1 Method of treating high plasma cholesterol levels HADVARY PAUL (CH) 2003-07-24 US claimed
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 claimed
CN-1359378-A 2-oxo-4H-3, 1-benzoxazine 4-ones for the treatment of obesity ALIZYME THERAPEUTICS LTD (GB) 2002-07-17 CN claimed
US-8877750-B2 2-oxy-benzoxazinone derivatives for the treatment of obesity NORGINE B.V. (NL) 2014-11-04 US disclosed
US-8877750-B2 2-oxy-benzoxazinone derivatives for the treatment of obesity NORGINE B.V. (NL) 2014-11-04 US disclosed
US-8877750-B2 2-oxy-benzoxazinone derivatives for the treatment of obesity NORGINE B.V. (NL) 2014-11-04 US disclosed
US-20130079391-A1 LIPASE INHIBITING COMPOSITION Hoffman-La Rochc Inc. (US) 2013-03-28 US disclosed
US-8372430-B2 comprises stiffening agents for ameliorating side effects associated with adminstration of lipase inhibitors (anal leakage of undigested fat or oil); for treatment of diabetes THE PROCTER & GAMBLE COMPANY (US) 2013-02-12 US disclosed
US-8343543-B2 Lipase inhibiting composition HOFFMANN-LA ROCHE INC. (US) 2013-01-01 US disclosed
US-20020035089-A1 Orlistat compositions CHEPLAPHARM ARZNEIMITTEL GMBH (DE) 2002-03-21 US disclosed
WO-2002011719-A2 LIPASE INHIBITORS FOR THE TREATMENT OF DYSPEPSIA F. HOFFMANN-LA ROCHE AG (CH) 2002-02-14 WO disclosed
US-20020018812-A1 Process for preparing a pharmaceutical composition CHEPLAPHARM ARZNEIMITTEL GMBH (DE) 2002-02-14 US disclosed
WO-2002009815-A2 NEW PHARMACEUTICAL COMPOSITION F. HOFFMANN-LA ROCHE AG (CH) 2002-02-07 WO disclosed
WO-2002009814-A2 NEW USE OF LIPASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2002-02-07 WO disclosed
WO-2002000201-A2 METHOD FOR PREPARING A COMPOSITION F. HOFFMANN-LA ROCHE AG (CH) 2002-01-03 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 (5 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-20020035089-A1 Orlistat compositions LIPC, CEL, PNLIP ELANE 734/4885MAPT 287/4885KDM4E 3916/4885
US-20130079391-A1 LIPASE INHIBITING COMPOSITION LIPC, PNLIP, CEL ELANE 180/4885MAPT 2670/4885KDM4E 2444/4885
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 ELANE 1134/4885MAPT 4061/4885KDM4E 1177/4885
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 ELANE 1412/4885MAPT 2799/4885KDM4E 1682/4885
US-20030138396-A1 Method of treating high plasma cholesterol levels LIPA, PNLIP, LIPC ELANE 596/4885MAPT 808/4885KDM4E 3648/4885

“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.