SCHEMBL9609767

SCHEMBL9609767

CCCCCCCNS(=O)(=O)CCCCCC

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RELA Q04206 4/20 0.71
PPARA Q07869 4/20 0.59
CA2 P00918 5/20 0.55
CA1 P00915 4/20 0.55
EPHX1 P07099 1/20 0.53
CA12 O43570 2/20 0.50
CA7 P43166 2/20 0.50
CA14 Q9ULX7 2/20 0.50
FAAH O00519 2/20 0.48
CA9 Q16790 1/20 0.46

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
SCHEMBL9832732 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1
SCHEMBL8713906 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1
SCHEMBL7688960 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1
SCHEMBL7685651 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1
SCHEMBL7694320 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1
SCHEMBL10438563 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1
SCHEMBL7109056 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1
SCHEMBL18572502 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1
SCHEMBL8468160 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1
SCHEMBL27604273 1.00 RELA (0.71) RELAPPARACA2CA1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921243-B2 Fabrics comprising a photocatalyst to produce singlet oxygen from ambient oxygen VENTANA RESEARCH CORPORATION 2014-12-30 US disclosed
US-20120135651-A1 Fabrics Comprising a Photocatalyst to Produce Singlet Oxygen from Ambient Oxygen VENTANA RESEARCH CORPORATION 2012-05-31 US disclosed