SCHEMBL9584994

SCHEMBL9584994

COCc1cc(OC)nc(N(C(N)=NN=Cc2ccccc2)S(=O)(=O)c2ccccc2C(=O)OC)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA5A P35218 1/20 0.34
CA9 Q16790 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
GRIN2D O15399 2/20 0.34
GRIN3B O60391 2/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2A Q12879 2/20 0.34
GRIN2B Q13224 2/20 0.34
GRIN2C Q14957 2/20 0.34
GRIN3A Q8TCU5 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
ALDH1A1 P00352 3/20 0.31
HSD17B10 Q99714 3/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL9586448 0.88 CA1 (0.40) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL9743094 0.79 CA1 (0.47) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL9368406 0.71 CA1 (0.44) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL9588686 0.70 CA1 (0.48) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL9587373 0.70 CA1 (0.48) CA1CA2CA5ACA9MEN1
SCHEMBL9587146 0.70 CA1 (0.41) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL9730399 0.70 CA1 (0.45) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL10502876 0.67 CA1 (0.44) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL9452140 0.67 CA1 (0.40) CA1CA2CA5ACA9SMN1; SMN2
SCHEMBL9586437 0.67 ALDH1A1 (0.38) CA1CA2CA5ACA9SMN1; SMN2

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