SCHEMBL1138932

SCHEMBL1138932

CCCCCCCCCCCCCCCCCC(=O)OC1CC(C)(C)N(OC(C)=O)C(C)(C)C1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.52
TSHR P16473 2/20 0.49
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 1/20 0.41
ESR1 P03372 1/20 0.41
HSD17B10 Q99714 1/20 0.41
DGKA P23743 1/20 0.38
PRKCA P17252 5/20 0.38
EPHX2 P34913 2/20 0.38

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
SCHEMBL12660726 0.99 NAAA (0.50) NAAATSHRKMT2AMEN1GAA
SCHEMBL1948723 0.94 TSHR (0.53) NAAATSHRKMT2AMEN1GAA
SCHEMBL9440185 0.93 TSHR (0.55) NAAATSHRKMT2AMEN1GAA
SCHEMBL1138659 0.93 NAAA (0.46) NAAATSHRKMT2AMEN1GAA
SCHEMBL1138686 0.92 NAAA (0.55) NAAATSHRKMT2AMEN1GAA
SCHEMBL1138472 0.91 NAAA (0.47) NAAATSHRKMT2AMEN1GAA
SCHEMBL9400337 0.90 NAAA (0.54) NAAATSHRKMT2AMEN1GAA
SCHEMBL10430889 0.89 NAAA (0.52) NAAATSHRKMT2AMEN1GAA
SCHEMBL1138999 0.89 KMT2A (0.58) NAAATSHRKMT2AMEN1GAA
SCHEMBL9440230 0.87 TSHR (0.57) NAAATSHRKMT2AMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9732168-B2 Method of preparing ethylene polymers by controlled high pressure polymerization BASF SE (DE) 2017-08-15 US disclosed
US-9732168-B2 Method of preparing ethylene polymers by controlled high pressure polymerization BASF SE (DE) 2017-08-15 US disclosed
US-20130150542-A1 Method Of Preparing Ethylene Polymers By Controlled High Pressure Polymerization BASF SE (DE) 2013-06-13 US disclosed
US-20130150542-A1 Method Of Preparing Ethylene Polymers By Controlled High Pressure Polymerization BASF SE (DE) 2013-06-13 US disclosed
US-8168725-B2 Degradation of polypropylene with hydroxylamine ester compositions BASF SE (DE) 2012-05-01 US disclosed
US-20110207892-A1 DEGRADATION OF POLYPROPYLENE WITH HYDROXYLAMINE ESTER COMPOSITIONS ROTH MICHAEL 2011-08-25 US disclosed
EP-1655303-B1 Process for the Controlled Increase in Molecular Weight of Polyethylene or Polyethylene Blends BASF SE (DE) 2011-02-23 EP disclosed
US-7820248-B2 Coating composition comprising hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2010-10-26 US disclosed
US-7820248-B2 Coating composition comprising hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2010-10-26 US disclosed
US-20100210800-A1 METHOD OF PREPARING ETHYLENE POLYMERS BY CONTROLLED HIGH PRESSURE POLYMERIZATION CIBA CORPORATION (US) 2010-08-19 US disclosed
EP-1727837-B1 METHOD OF PREPARING ETHYLENE POLYMERS BY CONTROLLED HIGH PRESSURE POLYMERIZATION CIBA SC HOLDING AG (CH) 2007-12-12 EP disclosed
US-7230042-B2 Flame retardant polymer compositions containing hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2007-06-12 US disclosed
US-7230042-B2 Flame retardant polymer compositions containing hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2007-06-12 US disclosed
US-20060128903-A1 Process for the controlled increase in the molecular weight of polyethylenes ROTH MICHAEL 2006-06-15 US disclosed
EP-1282630-B1 Process for Reducing the Molecular Weight of Polypropylene Using Hydroxylamine Esters CIBA SC HOLDING AG (CH) 2006-05-10 EP disclosed
EP-1655303-A2 Hydroxylamine esters as polimerization initiators Ciba SC Holding AG (CH) 2006-05-10 EP disclosed
US-7030196-B2 Process for reducing the molecular weight of polypropylene CIBA SPECIALTY CHEMICALS CORPORATION (US) 2006-04-18 US disclosed
US-20030216494-A1 Hydroxylamine esters as polymerization initiators CIBA SPECIALTY CHEMICALS CORP. 2003-11-20 US disclosed
EP-1282630-A1 HYDROXYLAMINE ESTERS AS POLYMERIZATION INITIATORS Ciba SC Holding AG (CH) 2003-02-12 EP disclosed
WO-2001090113-A1 HYDROXYLAMINE ESTERS AS POLYMERIZATION INITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-11-29 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 (1 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-20030216494-A1 Hydroxylamine esters as polymerization initiators PNMT, HPGDS, HAAO NAAA 273/4885TSHR 2473/4885KMT2A 1030/4885

“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.