SCHEMBL7934335

SCHEMBL7934335

COc1ncnc(NC(=O)N(C)S(=O)(=O)c2ccccc2C(=O)O)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.40
PRSS1 P07477 3/20 0.40
PRSS2 P07478 3/20 0.40
PRSS3 P35030 3/20 0.40
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP8 P22894 1/20 0.36
MMP13 P45452 1/20 0.36
GLA P06280 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
GAA P10253 1/20 0.36
CYP2C9 P11712 1/20 0.36
FABP4 P15090 2/20 0.35

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
SCHEMBL10508336 0.80 CA1 (0.46) CA1CA2MEN1KMT2AGAA
SCHEMBL7934333 0.75 CA1 (0.42) F2PRSS1PRSS2PRSS3CA1
SCHEMBL19417683 0.73 PTK2 (0.36) MEN1KMT2ACYP1A2CYP3A4GAA
SCHEMBL6868006 0.71 MTOR (0.46) CA1CA2MMP1MMP2MMP9
SCHEMBL13881366 0.71 PTK2 (0.35) GLAMEN1KMT2ATP53GAA
SCHEMBL10693785 0.70 GSTO1 (0.41) MEN1KMT2A
SCHEMBL10685495 0.69 MEN1 (0.35) MEN1KMT2ATP53
SCHEMBL7452390 0.68 MAPT (0.49) F2PRSS1PRSS2PRSS3CA1
SCHEMBL11093773 0.68 NPSR1 (0.35) MEN1KMT2A
SCHEMBL9620601 0.68 ALDH1A1 (0.49) F2GLAMEN1KMT2ATP53

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6221809-B1 Herbicidal compositions comprising N-[(4,6-dimethoxypyridin-2-yl)aminocarbonyl]-5-methylsulphonamidomethyl-2-alkoxycarbonylbenzene sulphonamides HOECHST SCHERING AGREVO GMBH (DE) 2001-04-24 US disclosed