Iodobenzene

Iodobenzene

SCHEMBL5315922

Ic1ccccc1.O=S(=O)(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 16/20 0.39
CA1 P00915 15/20 0.39
MMP1 P03956 6/20 0.39
MMP2 P08253 6/20 0.39
MMP9 P14780 6/20 0.39
MMP8 P22894 6/20 0.39
MMP13 P45452 6/20 0.39
PTPN1 P18031 1/20 0.36
F2 P00734 2/20 0.34
PRSS1 P07477 2/20 0.34
PRSS2 P07478 2/20 0.34
PRSS3 P35030 2/20 0.34
NR1H3 Q13133 1/20 0.33

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
Tert-Butylbenzene SCHEMBL5187676 0.85 HSD11B1 (0.38) CA2CA1MMP1MMP2MMP9
Diphenylsulfane SCHEMBL29961389 0.84 CA2 (0.38) CA2CA1MMP1MMP2MMP9
Biphenyl SCHEMBL1816739 0.84 PTPN1 (0.47) CA2CA1MMP1MMP2MMP9
Diphenylsulfane SCHEMBL27589904 0.83 CA2 (0.39) CA2CA1MMP1MMP2MMP9
SCHEMBL3680576 0.83 TRPV1 (0.44) CA2CA1MMP1MMP2MMP9
SCHEMBL3914557 0.83 CA2 (0.36) CA2CA1MMP1MMP2MMP9
Benzenethiol SCHEMBL29745974 0.82 CA2 (0.39) CA2CA1MMP1MMP2MMP9
SCHEMBL13836717 0.82 TSHR (0.57) CA2CA1MMP1MMP2MMP9
SCHEMBL3679476 0.81 TRPV1 (0.43) CA2CA1MMP1MMP2MMP9
SCHEMBL30275018 0.81 CA2 (0.36) CA2CA1MMP1MMP2MMP9

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
EP-1840650-A1 Positive type radiation-sensitive resin composition JSR Corporation (JP) 2007-10-03 EP disclosed