SCHEMBL9724745

SCHEMBL9724745

COCc1ccc(S(=O)(=O)C(C)(C)C)c(C(=O)OC)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
CDK1 P06493 1/20 0.43
CA2 P00918 5/20 0.41
CA1 P00915 3/20 0.38
CA9 Q16790 3/20 0.38
CA5A P35218 1/20 0.38
PTPN1 P18031 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CA12 O43570 2/20 0.37
CA7 P43166 2/20 0.37
CA14 Q9ULX7 2/20 0.37
PDK2 Q15119 1/20 0.37
PDK4 Q16654 1/20 0.37

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
SCHEMBL9724720 0.87 CA2 (0.46) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL20887338 0.75 CA12 (0.66) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL23292500 0.74 HPGD (0.54) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL26466965 0.74 ALDH1A1 (0.76) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL17478646 0.74 HPGD (0.49) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL13162022 0.72 CA12 (0.47) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL9724767 0.71 GAA (0.54) MAPTGAACDK1TP53
SCHEMBL9724769 0.71 CA2 (0.48) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL13162548 0.71 ALDH1A1 (0.60) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL22006228 0.71 CA12 (0.46) KDM4EALDH1A1HSD17B10MAPTHPGD

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-5160363-A For sugarbeets E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-11-03 US disclosed
EP-0422031-A1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-04-17 EP disclosed
WO-1989010921-A1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-11-16 WO disclosed