SCHEMBL3789484

SCHEMBL3789484

CCCNS(=O)(=O)[N]CC

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.52
PPARA Q07869 3/20 0.41
CA2 P00918 5/20 0.37
CA12 O43570 3/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA9 Q16790 2/20 0.35

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
SCHEMBL2496015 0.83 CA1 (0.50) CA1PPARACA2CA12CA7
SCHEMBL3803007 0.82 PPARA (0.55) CA1PPARACA2CA12CA7
SCHEMBL41948 0.77
SCHEMBL31519018 0.70 CA1 (0.46) CA1PPARACA2CA12CA7
SCHEMBL9651043 0.69 CA1 (1.00) CA1PPARACA2CA12CA7
SCHEMBL242928 0.69
SCHEMBL3792243 0.67 PPARA (0.53) CA1PPARACA2CA12CA7
SCHEMBL736693 0.67
SCHEMBL805368 0.67
SCHEMBL12847282 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2168181-B1 MIXTURES FOR PRODUCING PHOTOACTIVE LAYERS FOR ORGANIC SOLAR CELLS AND ORGANIC PHOTODETECTORS HELIATEK GMBH (DE) 2021-05-12 EP disclosed
US-20100140559-A1 MIXTURES FOR PRODUCING PHOTOACTIVE LAYERS FOR ORGANIC SOLAR CELLS AND ORGANIC PHOTODETECTORS BASF SE (DE) 2010-06-10 US disclosed
EP-2168181-A1 MIXTURES FOR PRODUCING PHOTOACTIVE LAYERS FOR ORGANIC SOLAR CELLS AND ORGANIC PHOTODETECTORS BASF SE (DE) 2010-03-31 EP disclosed
WO-2009007340-A1 MIXTURES FOR PRODUCING PHOTOACTIVE LAYERS FOR ORGANIC SOLAR CELLS AND ORGANIC PHOTODETECTORS BASF SE (DE) 2009-01-15 WO disclosed