SCHEMBL7846189

SCHEMBL7846189

CCCCCS(=O)(=O)CCCCCOCCCCCS(=O)(=O)CCCCC

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.54
MEN1 O00255 1/20 0.50
THRB P10828 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
FAAH O00519 5/20 0.48
CES2 O00748 3/20 0.48
CES1 P23141 1/20 0.48
CA1 P00915 8/20 0.48
CA9 Q16790 7/20 0.48
CA12 O43570 3/20 0.48
CA7 P43166 3/20 0.48
CA14 Q9ULX7 3/20 0.48
CA3 P07451 2/20 0.48
CA4 P22748 2/20 0.48
CA6 P23280 2/20 0.48
CA5A P35218 2/20 0.48
CA5B Q9Y2D0 2/20 0.48

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
SCHEMBL10695392 1.00 CA2 (0.54) CA2MEN1THRBHTTKMT2A
SCHEMBL10693136 0.95 MEN1 (0.50) CA2MEN1THRBHTTKMT2A
SCHEMBL5442905 0.95 MEN1 (0.50) CA2MEN1THRBHTTKMT2A
SCHEMBL393510 0.85 CA2 (0.68) CA2THRBFAAHCES2CES1
SCHEMBL5586100 0.85 CA2 (0.68) CA2THRBFAAHCES2CES1
SCHEMBL5379286 0.85 CA2 (0.68) CA2THRBFAAHCES2CES1
SCHEMBL8778763 0.85 CA2 (0.68) CA2THRBFAAHCES2CES1
SCHEMBL350042 0.85 CA2 (0.68) CA2THRBFAAHCES2CES1
SCHEMBL8778750 0.85 CA2 (0.68) CA2THRBFAAHCES2CES1
SCHEMBL8778769 0.85 CA2 (0.68) CA2THRBFAAHCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2001106668-A PRODUCTION OF BIS[(ARYLSULFONYL)ARYL] ETHER COMPOUNDS MITSUI CHEMICALS INC 2001-04-17 JP disclosed