SCHEMBL9023670

SCHEMBL9023670

COC(=O)N(C)NS(=O)(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.51
BCAT1 P54687 2/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP8 P22894 1/20 0.46
MMP13 P45452 1/20 0.46
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 2/20 0.42
KMT2A Q03164 1/20 0.42
EGFR P00533 1/20 0.42
ERBB2 P04626 1/20 0.42
MAPK1 P28482 1/20 0.41
KAT6A Q92794 1/20 0.41
HSD11B1 P28845 1/20 0.41
PKM P14618 1/20 0.40

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
SCHEMBL7215570 0.75 CA1 (0.52) PTGESBCAT1CA1CA2MMP1
SCHEMBL15512616 0.71 BCAT1 (0.53) PTGESBCAT1CA1CA2MMP1
SCHEMBL11514440 0.71 KMT2A (0.51) PTGESALDH1A1HTTGAAKMT2A
SCHEMBL16177890 0.71 PSIP1 (0.48) BCAT1CA1CA2MMP1MMP2
SCHEMBL3651088 0.71 EGFR (0.54) BCAT1CA1CA2MMP1MMP2
SCHEMBL10448678 0.71 BCAT1 (0.47) BCAT1CA1CA2MMP1MMP2
SCHEMBL11513730 0.68 MEN1 (0.72) BCAT1ALDH1A1HTTGAAKMT2A
SCHEMBL28204994 0.68 CA1 (0.48) PTGESBCAT1CA1CA2MMP1
SCHEMBL366135 0.67 CA2 (0.52) BCAT1CA1CA2MMP1MMP2
SCHEMBL11512832 0.67 ALDH1A1 (0.44) PTGESALDH1A1GAAKMT2AMAPK1

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
EP-0706518-A1 ACYLATED AMINOPHENYL UREA COMPOUNDS, THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT-GROWTH REGULATORS Hoechst Schering AgrEvo GmbH (DE) 1996-04-17 EP disclosed
WO-1995001344-A1 ACYLATED AMINOPHENYL UREA COMPOUNDS, THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT-GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1995-01-12 WO disclosed