SCHEMBL2447508

SCHEMBL2447508

O=S(=O)(NC1CC1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 10/20 0.62
DPP7 Q9UHL4 9/20 0.62
KCNH2 Q12809 5/20 0.62
L3MBTL1 Q9Y468 1/20 0.60
DPP8 Q6V1X1 2/20 0.56
DPP9 Q86TI2 2/20 0.56
KDM4E B2RXH2 1/20 0.56
RECQL P46063 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
DRD2 P14416 1/20 0.54
ADRA1D P25100 1/20 0.54
ADRA1A P35348 1/20 0.54
ADRA1B P35368 1/20 0.54
KMT2A Q03164 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
MEN1 O00255 1/20 0.51
FFAR4 Q5NUL3 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51

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
SCHEMBL1723334 0.89 DPP4 (0.56) DPP4DPP7KCNH2L3MBTL1DPP8
SCHEMBL5363805 0.82 DPP4 (0.50) DPP4DPP7KCNH2L3MBTL1DPP8
SCHEMBL5363799 0.82 DPP4 (0.50) DPP4DPP7KCNH2L3MBTL1DPP8
SCHEMBL23052440 0.81 EPHX2 (0.57) DPP4DPP7KCNH2SMN1; SMN2KMT2A
SCHEMBL14707119 0.79 DPP4 (0.48) DPP4DPP7KCNH2L3MBTL1DPP8
SCHEMBL27225701 0.79 DPP4 (0.48) DPP4DPP7KCNH2L3MBTL1DPP8
SCHEMBL27228802 0.79 DPP4 (0.48) DPP4DPP7KCNH2L3MBTL1DPP8
SCHEMBL22349421 0.79 MMP2 (0.63) DPP4DPP7KCNH2L3MBTL1FFAR4
SCHEMBL26536419 0.79 MMP2 (0.67) DPP4DPP7KCNH2L3MBTL1DPP8
SCHEMBL2198270 0.79 KMT2A (0.50) DPP4DPP7KCNH2L3MBTL1DPP8

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-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 US claimed
US-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 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-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS STS, ARSA, TST DPP4 3071/4885DPP7 2951/4885KCNH2 3085/4885

“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.