SCHEMBL5697668

SCHEMBL5697668

CC1(O)CC(C)(C)N(O)C(C)(C)C1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL289296 0.87
SCHEMBL14546083 0.81 GAA (0.35) GAAL3MBTL1ALDH1A1
SCHEMBL1698695 0.75 TSHR (0.33)
SCHEMBL7559779 0.73 GAA (0.33) GAAL3MBTL1
SCHEMBL17931805 0.73 OPRM1 (0.32) GAAL3MBTL1
SCHEMBL5697656 0.73 ALDH1A1 (0.31) GAAL3MBTL1ALDH1A1
SCHEMBL17620649 0.71
SCHEMBL5697628 0.71 ALDH1A1 (0.30) ALDH1A1
SCHEMBL18329679 0.71
SCHEMBL9727890 0.71 ALDH1A1 (0.38) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10221255-B2 Composition for the immediate stopping of a free-radical polymerization BASF SE (DE) 2019-03-05 US disclosed
US-20180171035-A1 COMPOSITION FOR THE IMMEDIATE STOPPING OF A FREE-RADICAL POLYMERIZATION BASF SE (DE) 2018-06-21 US disclosed
US-20180171035-A1 COMPOSITION FOR THE IMMEDIATE STOPPING OF A FREE-RADICAL POLYMERIZATION BASF SE (DE) 2018-06-21 US disclosed
WO-2015032951-A1 A PROCESS FOR THE PREPARATION OF A CONDUCTIVE POLYMER COMPOSITE UNIVERSITE CATHOLIQUE DE LOUVAIN (BE) 2015-03-12 WO disclosed
US-20070231744-A1 Holographic recording medium KABUSHIKI KAISHA TOSHIBA (JP) 2007-10-04 US disclosed
EP-1297038-B1 RUBBER-CONTAINING STYRENE POLYMERS WITH IMPROVED IMPACT RESISTANCE BASF AG (DE) 2006-08-02 EP disclosed
EP-1144353-B1 METHOD FOR STABILIZING CHEMICAL COMPOUNDS CONTAINING AT LEAST ONE ETHYLENICALLY UNSATURATED BOND IN ORDER TO PREVENT UNDESIRABLE RADICAL POLYMERIZATION BASF AG (DE) 2005-12-28 EP disclosed
WO-2004108783-A1 BLOCK COPOLYMERS BASF AKTIENGESELLSCHAFT (DE) 2004-12-16 WO disclosed
US-6726854-B2 FOR STABILIZATION OF VINYLICALLY UNSATURATED COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2004-04-27 US disclosed
EP-1077245-B1 Inhibitor composition for stabilising radically polymerisable substances BASF AG (DE) 2004-01-07 EP disclosed
US-6518453-B1 In a process for stabilizing chemical compounds having at least one ethylenically unsaturated bond to undesired free radical polymerization, a nitroxyl radical and a chemical compound containing phosphorus in chemically bonded form are BASF AKTIENGESELLSCHAFT (DE) 2003-02-11 US disclosed
US-6518452-B1 A method of stabilizing an ester of (meth)acrylic acid against free-radical polymerization, comprising: adding to said ester of (meth)acrylic acid a polymerization inhibitor which comprises at least one nitroxyl radical and/or at least BASF AKTIENGESELLSCHAFT (DE) 2003-02-11 US disclosed
US-H1957-H1 ADDING A PHENOTHIAZINE-CONTAINING SOLUTION WHOSE SOLVENT COMPRISES AT LEAST 50% OF ITS WEIGHT OF AN N-ALKYLPYRROLIDONE BASF AKTIENGESELLSCHAFT (DE) 2001-04-03 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 (2 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-10221255-B2 Composition for the immediate stopping of a free-radical polymerization FASTKD5, TYK2, FASTKD1 GAA 4489/4885L3MBTL1 3957/4885ALDH1A1 1387/4885
US-20180171035-A1 COMPOSITION FOR THE IMMEDIATE STOPPING OF A FREE-RADICAL POLYMERIZATION FASTKD5, TYK2, FASTKD1 GAA 4489/4885L3MBTL1 3957/4885ALDH1A1 1387/4885

“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.