SCHEMBL9587146

SCHEMBL9587146

COC(=O)c1ccccc1S(=O)(=O)N(C(N)=NN=C(c1ccccc1)c1ccccc1)c1nc(C)cc(C)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA5A P35218 1/20 0.41
CA9 Q16790 1/20 0.41
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.35
F2 P00734 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
KDM4E B2RXH2 3/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 2/20 0.35
SLC40A1 Q9NP59 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL9588686 0.88 CA1 (0.48) CA1CA2CA5ACA9TDP1
SCHEMBL10502876 0.84 CA1 (0.44) CA1CA2CA5ACA9TDP1
SCHEMBL6054812 0.83 CA1 (0.50) CA1CA2CA5ACA9TDP1
SCHEMBL9743094 0.77 CA1 (0.47) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL9587373 0.75 CA1 (0.48) CA1CA2CA5ACA9TDP1
SCHEMBL4286897 0.73 F2 (0.43) CA1CA2CA9SMN1; SMN2ALDH1A1
SCHEMBL10865204 0.72 ALDH1A1 (0.41) TDP1L3MBTL1SMN1; SMN2ALDH1A1LMNA
SCHEMBL9586448 0.70 CA1 (0.40) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL9584994 0.70 CA1 (0.34) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL8848745 0.69 CA1 (0.46) CA1CA2CA5ACA9L3MBTL1

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-5213608-A Sulfonylguanidines BAYER AKTIENGESELLSCHAFT (DE) 1993-05-25 US disclosed
US-5167692-A Pre- and postemergence BAYER AKTIENGESELLSCHAFT (DE) 1992-12-01 US disclosed
EP-0431270-A1 Substituted sulfonylamidinohydrazones BAYER AG (DE) 1991-06-12 EP disclosed