SCHEMBL2078046

SCHEMBL2078046

O=c1oc(OCCCCCCCCCCCCCCO)nc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 13/20 0.63
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TP53 P04637 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL2078354 0.86 ELANE (0.60) ELANE
SCHEMBL13039558 0.86 ELANE (0.72) ELANEMEN1KMT2ATP53SMN1; SMN2
SCHEMBL12777968 0.86 ELANE (0.72) ELANEMEN1KMT2ATP53SMN1; SMN2
SCHEMBL12777984 0.86 ELANE (0.72) ELANEMEN1KMT2ATP53SMN1; SMN2
SCHEMBL2077538 0.86 ELANE (0.72) ELANEMEN1KMT2ATP53SMN1; SMN2
SCHEMBL12844728 0.86 ELANE (0.72) ELANEMEN1KMT2ATP53SMN1; SMN2
SCHEMBL2078449 0.86 ELANE (0.72) ELANEMEN1KMT2ATP53SMN1; SMN2
SCHEMBL2077985 0.86 ELANE (0.63) ELANEMEN1KMT2ATP53SMN1; SMN2
SCHEMBL2075626 0.86 ELANE (0.68) ELANETP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL10657814 0.85 ELANE (0.68) ELANEMEN1KMT2A

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
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-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
EP-1143977-B3 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY NORGINE BV (NL) 2012-10-24 EP disclosed
EP-1572240-B1 COMPOSITIONS, METHODS, AND KITS USEFUL FOR THE ALLEVIATION OF GASTROINTESTINAL SIDE EFFECTS OF LIPASE INHIBITORS PROCTER & GAMBLE (US) 2011-09-21 EP disclosed
US-20110065697-A1 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY NORGINE B.V. (NL) 2011-03-17 US disclosed
US-20110065697-A1 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY NORGINE B.V. (NL) 2011-03-17 US 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
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
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
US-20080075688-A1 Use of non-digestible polymeric foams to sequester ingested materials thereby inhibiting their absorption by the body THE PROCTER & GAMBLE COMPANY 2008-03-27 US disclosed
EP-1572240-A1 COMPOSITIONS, METHODS, AND KITS USEFUL FOR THE ALLEVIATION OF GASTROINTESTINAL SIDE EFFECTS OF LIPASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2005-09-14 EP disclosed
WO-2004060401-A1 COMPOSITIONS, METHODS, AND KITS USEFUL FOR THE ALLEVIATION OF GASTROINTESTINAL SIDE EFFECTS OF LIPASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2004-07-22 WO disclosed
US-20040126424-A1 Compositions, methods, and kits useful for the alleviation of gastrointestinal effects JANDACEK RONALD JAMES (US) 2004-07-01 US disclosed
US-20040091450-A1 Use of non-digestible polymeric foams to sequester ingested materials thereby inhibiting their absorption by the body THE PROCTER & GAMBLE COMPANY 2004-05-13 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

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-20080161301-A1 2-hexadecyloxy-6-methyl-4H-3,1-benzoxazin-4-one; inhibition of a lipase, esterase or phosphatase enzyme LPL, LIPE, PNLIP ELANE 419/4885MEN1 4740/4885KMT2A 852/4885
US-20080075688-A1 Use of non-digestible polymeric foams to sequester ingested materials thereby inhibiting their absorption by the body LIPA, PNLIP, CEL ELANE 73/4885MEN1 4435/4885KMT2A 3624/4885
US-20110065697-A1 2-OXY-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY CYP1B1, CYP4X1, ACOX1 ELANE 1015/4885MEN1 4832/4885KMT2A 1468/4885
US-20040126424-A1 Compositions, methods, and kits useful for the alleviation of gastrointestinal effects PNLIP, LIPC, LIPA ELANE 260/4885MEN1 4329/4885KMT2A 2606/4885
US-20040091450-A1 Use of non-digestible polymeric foams to sequester ingested materials thereby inhibiting their absorption by the body LIPA, PNLIP, CEL ELANE 73/4885MEN1 4435/4885KMT2A 3624/4885

“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.