SCHEMBL3792285

SCHEMBL3792285

CC(C)CN(CC(C)C)S(N)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.46
CA1 P00915 5/20 0.46
CA12 O43570 3/20 0.46
CA14 Q9ULX7 1/20 0.46
TAS2R14 Q9NYV8 1/20 0.37
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RORC P51449 4/20 0.34
CA9 Q16790 4/20 0.33
TSHR P16473 1/20 0.32
MMP3 P08254 2/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 1/20 0.30
MMP14 P50281 1/20 0.30
ADAM17 P78536 1/20 0.30
PER2 O15055 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
SCHEMBL24392423 0.76 CA1 (0.33) CA2CA1CA12CA14CA9
SCHEMBL21210958 0.76 CA1 (0.33) CA2CA1CA12CA14CA9
SCHEMBL10312295 0.74 PER2 (0.45) CA2CA1CA12TAS2R14LMNA
SCHEMBL4408492 0.74 CA1 (0.34) CA2CA1CA12CA14RORC
SCHEMBL1038818 0.72 TAS2R14 (0.41) CA2CA1CA12TAS2R14LMNA
SCHEMBL3792283 0.72 TAS2R14 (0.37) CA2CA1CA12TAS2R14LMNA
SCHEMBL10486689 0.72 CA1 (0.37) CA2CA1CA12CA14CA9
SCHEMBL24391595 0.72 CA1 (0.71) CA2CA1CA12CA14LMNA
SCHEMBL24391582 0.72 PIK3CD (0.34) CA2CA1CA12CA14PER2
SCHEMBL6865202 0.69 TAS2R14 (0.35) CA2CA1CA12CA14TAS2R14

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