SCHEMBL17355695

SCHEMBL17355695

CS(=O)(=O)Oc1cc(F)ccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.41
IDO1 P14902 2/20 0.37
ALDH1A1 P00352 2/20 0.35
PTGS2 P35354 1/20 0.35
PPARG P37231 1/20 0.35
DRD2 P14416 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MITF O75030 1/20 0.34
LMNA P02545 1/20 0.34
STAT3 P40763 1/20 0.34
STAT1 P42224 1/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TLR9 Q9NR96 1/20 0.34
HTR1A P08908 1/20 0.34
HTR2A P28223 1/20 0.34
HTR7 P34969 1/20 0.34
HTR6 P50406 1/20 0.34
HSD11B1 P28845 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
SCHEMBL17352156 0.86 MRGPRX4 (0.41) KIF11IDO1ALDH1A1KDM4EHSD11B1
SCHEMBL15453941 0.83 CES2 (0.43) KIF11ALDH1A1KDM4E
SCHEMBL6941315 0.80 SLC22A12 (0.40) ALDH1A1PPARGSMN1; SMN2LMNANPSR1
SCHEMBL3751243 0.78 PTGS2 (0.37) PTGS2SMN1; SMN2KDM4E
SCHEMBL9957765 0.77 KDM4E (0.49) ALDH1A1PTGS2SMN1; SMN2KDM4ELMNA
SCHEMBL17352142 0.76 KIF11 (0.37) KIF11IDO1SMN1; SMN2
SCHEMBL13347574 0.76 HTR2A (0.45) IDO1DRD2HTR2A
SCHEMBL9958058 0.75 KDM4E (0.47) ALDH1A1PTGS2SMN1; SMN2KDM4ELMNA
SCHEMBL3746820 0.74 PTGS2 (0.43) ALDH1A1PTGS2KDM4E
SCHEMBL15453722 0.74 KIF11 (0.35) KIF11ALDH1A1PTGS2KDM4E

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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 US disclosed
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE HCN2, SCO2, HCN1 KIF11 2611/4885IDO1 4571/4885ALDH1A1 1059/4885

“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.