SCHEMBL4408313

SCHEMBL4408313

CC(=O)CC(=O)OC1CC(C)(C)N(O)C(C)(C)C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.43
HTT P42858 1/20 0.43
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
KMT2A Q03164 3/20 0.35
TSHR P16473 2/20 0.35
ALDH1A1 P00352 2/20 0.34
ESR1 P03372 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX15 P16050 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL272468 0.91 GAA (0.47) GAAHTTKMT2ATSHRALDH1A1
Butane SCHEMBL10595891 0.86 GAA (0.43) GAAHTTKMT2ATSHRALDH1A1
SCHEMBL9682713 0.86 GAA (0.38) GAAHTTMGAMSIMGAM2
SCHEMBL13328945 0.84 GAA (0.44) GAAHTTKMT2ATSHRALDH1A1
SCHEMBL317176 0.84 GAA (0.47) GAAHTTKMT2ATSHRALDH1A1
SCHEMBL10171546 0.83 TSHR (0.46) GAAHTTMGAMSIMGAM2
SCHEMBL4412312 0.83 TSHR (0.45) GAAHTTKMT2ATSHRALDH1A1
SCHEMBL1150065 0.82 GAA (0.46) GAAHTTKMT2ATSHRALDH1A1
SCHEMBL3765199 0.81 GAA (0.50) GAAHTTKMT2ATSHRALDH1A1
SCHEMBL13017813 0.81 GAA (0.37) GAAMGAMSIMGAM2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1095006-A1 DERIVATIVES OF 1-OXYL-4-HYDROXY-OR 4-AMINO-2,2,6,6-TETRAMETHYLPIPERIDINE AS POLYMERIZATION INHIBITORS FOR (METH) ACRYLATE MONOMERS Ciba SC Holding AG (CH) 2001-05-02 EP claimed
WO-2000003965-A1 DERIVATIVES OF 1-OXYL-4-HYDROXY- OR 4-AMINO-2,2,6,6-TETRAMETHYLPIPERIDINE AS POLYMERIZATION INHIBITORS FOR (METH)ACRYLATE MONOMERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-01-27 WO claimed
US-5932735-A STABILIZERS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-03 US claimed
EP-2030963-A2 Derivatives of 1-oxyl-4-hydroxy-or 4-amino-2,2,6,6-tetramethylpiperidine as polymerization inhibitors for (meth) acrylate monomers Ciba Holding Inc. (CH) 2009-03-04 EP disclosed
EP-1095006-A1 DERIVATIVES OF 1-OXYL-4-HYDROXY-OR 4-AMINO-2,2,6,6-TETRAMETHYLPIPERIDINE AS POLYMERIZATION INHIBITORS FOR (METH) ACRYLATE MONOMERS Ciba SC Holding AG (CH) 2001-05-02 EP disclosed
EP-1000032-A1 INHIBITION OF PULP AND PAPER YELLOWING USING NITROXIDES AND OTHER COADDITIVES Ciba SC Holding AG (CH) 2000-05-17 EP disclosed
WO-2000003965-A1 DERIVATIVES OF 1-OXYL-4-HYDROXY- OR 4-AMINO-2,2,6,6-TETRAMETHYLPIPERIDINE AS POLYMERIZATION INHIBITORS FOR (METH)ACRYLATE MONOMERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-01-27 WO disclosed
WO-1999005108-A1 INHIBITION OF PULP AND PAPER YELLOWING USING NITROXIDES AND OTHER COADDITIVES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1999-02-04 WO disclosed