Toliodium

Toliodium

SCHEMBL7708774

Cc1ccc([I+]c2ccc(C)cc2)cc1.O=S(=O)([O-])C(F)(F)C(F)C(F)(F)F

nearest known ligand 0.36

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGER Q15109 1/20 0.36
TLR9 Q9NR96 1/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA5A P35218 2/20 0.34
CA9 Q16790 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
GAA P10253 2/20 0.33
KCNH2 Q12809 1/20 0.32
GPR3 P46089 1/20 0.32
CA12 O43570 1/20 0.32
CA3 P07451 1/20 0.32
CA6 P23280 1/20 0.32
CA7 P43166 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
ACHE P22303 2/20 0.30
PKM P14618 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL7708455 0.94 GPR3 (0.35) AGERTLR9CA1CA2CA5A
SCHEMBL7705618 0.85 ALDH1A1 (0.38) CA1CA2CA9LMNAHPGD
SCHEMBL7708128 0.84 GPR3 (0.34) CA1CA2CA5ACA9LMNA
SCHEMBL7708731 0.81 ALDH1A1 (0.35) ALDH1A1
Toliodium SCHEMBL2898696 0.81 GPR3 (0.44) AGERTLR9CA1CA2CA5A
SCHEMBL7702833 0.81 AGER (0.36) AGERTLR9CA1CA2CA5A
SCHEMBL7708628 0.80 HSD11B1 (0.38) ACHEALDH1A1SMN1; SMN2
SCHEMBL7708768 0.80 AGER (0.35) AGERTLR9CA1CA2CA5A
SCHEMBL7702881 0.77 LMNA (0.40) LMNAHPGDHTTALDH1A1SMN1; SMN2
SCHEMBL7702718 0.77 GPR3 (0.35) AGERCA1CA2CA5ACA9

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-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed