SCHEMBL5050663

SCHEMBL5050663

C=C(C)C(=O)OOC1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
ALDH1A1 P00352 2/20 0.33
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL107001 0.82 GAA (0.49) GAAALDH1A1ATML3MBTL1
SCHEMBL27780209 0.82 GAA (0.44) GAAALDH1A1ATML3MBTL1
Water SCHEMBL27951717 0.81 GAA (0.47) GAAALDH1A1ATML3MBTL1
SCHEMBL5549608 0.80 ALDH1A1 (0.33) ALDH1A1
SCHEMBL5551604 0.76 GAA (0.40) GAAATML3MBTL1
SCHEMBL15880773 0.76 TSHR (0.33) GAAALDH1A1
SCHEMBL10440870 0.75 GAA (0.49) GAAATML3MBTL1
SCHEMBL17250051 0.74 THRB (0.44) GAAALDH1A1
SCHEMBL15880778 0.73 TSHR (0.34) GAAALDH1A1
SCHEMBL18935833 0.73 GAA (0.41) GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008104683-A1 ELECTRODE CONTAINING AT LEAST ONE NITROXIDE AND CARBON NANOTUBES ARKEMA FRANCE (FR) 2008-09-04 WO claimed
US-7262250-B2 Scorch-retardant composition ARKEMA FRANCE (FR) 2007-08-28 US claimed
EP-1322701-B1 SCORCH-DELAYING COMPOSITION ATOFINA (FR) 2004-11-24 EP claimed
US-20040198920-A1 Scorch-retardant composition ATOFINA 2004-10-07 US claimed
WO-2025024934-A1 COLOUR CHANGING ELECTROCHROMIC DEVICE AND METHOD OF MANUFACTURING THEREOF TRUSSCORE INC. (CA) 2025-02-06 WO disclosed
WO-2008104683-A1 ELECTRODE CONTAINING AT LEAST ONE NITROXIDE AND CARBON NANOTUBES ARKEMA FRANCE (FR) 2008-09-04 WO disclosed
US-7262250-B2 Scorch-retardant composition ARKEMA FRANCE (FR) 2007-08-28 US disclosed
US-20050192419-A1 Scorch-retardant composition ARKEMA FRANCE (FR) 2005-09-01 US disclosed
US-20040198920-A1 Scorch-retardant composition ATOFINA 2004-10-07 US disclosed
EP-1322701-A2 SCORCH-DELAYING COMPOSITION Atofina (FR) 2003-07-02 EP disclosed
WO-2002028950-A2 SCORCH-DELAYING COMPOSITION ATOFINA (FR) 2002-04-11 WO disclosed