SCHEMBL2106680

SCHEMBL2106680

N#Cc1cccc(-c2c(Br)[c]c(Br)cc2S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 4/20 0.37
VEGFA P15692 1/20 0.37
PTPN5 P54829 1/20 0.35
ENPP1 P22413 1/20 0.34
SLC22A12 Q96S37 1/20 0.33
CNR2 P34972 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
TGFBR1 P36897 1/20 0.32
PDK2 Q15119 2/20 0.32
PDK1 Q15118 1/20 0.32
PDK3 Q15120 1/20 0.32
PDK4 Q16654 1/20 0.32
ARNT P27540 1/20 0.32
RIPK2 O43353 1/20 0.32
PTGES2 Q9H7Z7 1/20 0.32
MAT2A P31153 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
TRPV4 Q9HBA0 1/20 0.31

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
SCHEMBL2104893 0.88 HSD11B1 (0.33) EPAS1VEGFAPTPN5SLC22A12TRPV4
SCHEMBL2102804 0.84 PTPN1 (0.35)
SCHEMBL12003751 0.80 EPAS1 (0.35) EPAS1VEGFASLC22A12PDK2PDK1
SCHEMBL2105993 0.80 PTGS2 (0.34) PDE4APDE4CPDE4D
SCHEMBL2106679 0.79 HSD11B1 (0.32) PTPN5SLC22A12PDK2
SCHEMBL2104840 0.78 EPAS1 (0.32) EPAS1
SCHEMBL2105340 0.78 PTGS2 (0.33)
SCHEMBL2106885 0.78 PTGS2 (0.32)
SCHEMBL1949838 0.77 ENPP1 (0.36) EPAS1VEGFAPTPN5ENPP1CNR2
SCHEMBL2102822 0.77 EPAS1 (0.31) EPAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8563736-B2 Amide derivatives, process for preparation thereof and use thereof as insecticide MITSUI CHEMICALS, INC. (JP) 2013-10-22 US disclosed
US-8163804-B2 Composition for preventing harmful organisms MITSUI CHEMICALS, INC. (JP) 2012-04-24 US disclosed
US-20090162453-A1 COMPOSITION FOR PREVENTING HARMFUL ORGANISMS MITSUI CHEMICALS, INC (JP) 2009-06-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090162453-A1 COMPOSITION FOR PREVENTING HARMFUL ORGANISMS PRDX3, CYP1A1, GSTA1 EPAS1 4130/4885VEGFA 4024/4885PTPN5 1415/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.