SCHEMBL11087504

SCHEMBL11087504

CC(C)NS(=O)(=O)c1cccc(F)c1C#N

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SGK1 O00141 1/20 0.41
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CNR2 P34972 1/20 0.37
KAT6A Q92794 3/20 0.36
HTR2B P41595 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRK1 P41145 1/20 0.36
SLC22A12 Q96S37 1/20 0.35
DRD2 P14416 1/20 0.34
HTR2A P28223 1/20 0.34
HRH1 P35367 1/20 0.34
PIK3CD O00329 2/20 0.34

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
SCHEMBL11086919 0.82 CCR4 (0.49) SGK1ALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL29707957 0.79 CNR2 (0.50) ALDH1A1KDM4ELMNASMN1; SMN2CNR2
SCHEMBL7912922 0.79 CNR2 (0.50) ALDH1A1KDM4ELMNASMN1; SMN2CNR2
SCHEMBL11092954 0.78 SGK1 (0.40) SGK1ALDH1A1KDM4EKAT6ASLC22A12
SCHEMBL15461576 0.77 EPAS1 (0.45) SGK1ALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL11088671 0.75 SLC22A12 (0.41) SGK1ALDH1A1KAT6ASLC22A12
SCHEMBL16000126 0.74 LMNA (0.54) ALDH1A1LMNAKAT6AOPRM1OPRK1
SCHEMBL11085124 0.74 PTGES2 (0.44) SGK1ALDH1A1KDM4E
SCHEMBL970204 0.74 TRPV4 (0.42) SGK1ALDH1A1KDM4EKAT6ASLC22A12
SCHEMBL11089868 0.73 ALDH1A1 (0.56) SGK1ALDH1A1KDM4ESMN1; SMN2KAT6A

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
EP-0033984-B1 NEW SULPHONYL COMPOUNDS, METHOD OF PREPARING THE NEW COMPOUNDS, AS WELL AS APHICIDAL COMPOSITIONS ON THE BASIS OF THE NEW COMPOUNDS DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1984-06-06 EP disclosed
US-4379157-A Sulphonyl compounds, method of preparing the new compounds, as well as aphicidal compositions on the basis of the new compounds DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1983-04-05 US disclosed
EP-0033984-A1 New sulphonyl compounds, method of preparing the new compounds, as well as aphicidal compositions on the basis of the new compounds DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1981-08-19 EP disclosed