SCHEMBL7952759

SCHEMBL7952759

COC(=O)c1ccc(NN=C2CCCC2)cc1S(N)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.48
CA1 P00915 4/20 0.48
CA9 Q16790 3/20 0.48
CA5A P35218 1/20 0.48
YAP1 P46937 1/20 0.40
GAA P10253 3/20 0.40
CA12 O43570 3/20 0.38
CA14 Q9ULX7 2/20 0.38
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CDK1 P06493 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GLA P06280 1/20 0.37
HPGD P15428 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
SCHEMBL7944395 0.90 CA2 (0.48) CA2CA1CA9CA5AYAP1
SCHEMBL7944355 0.85 ALDH1A1 (0.40) GAAMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL8536174 0.79 CA2 (0.51) CA2CA1CA9CA5AYAP1
SCHEMBL8536178 0.79 CA2 (0.51) CA2CA1CA9CA5AYAP1
SCHEMBL8539148 0.77 CA2 (0.59) CA2CA1CA9CA5AYAP1
SCHEMBL7944391 0.76 CDK1 (0.55) GAAMAPTCDK1NPC1GLA
SCHEMBL9196479 0.75 CA2 (0.47) CA2CA1CA9CA5AYAP1
SCHEMBL9196481 0.75 CA2 (0.47) CA2CA1CA9CA5AYAP1
SCHEMBL11372105 0.74 CA1 (0.63) CA2CA1CA9CA5AGAA
SCHEMBL8539913 0.74 CA2 (0.55) CA2CA1CA9CA5AYAP1

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
US-6265348-B1 Alkylidenehydrazinophenylsulfonylureas, processes for their preparation and their use as herbicides and plant growth regulators HOECHST SCHERING AGREVO GMBH (DE) 2001-07-24 US disclosed
US-5922645-A PRE-EMERGENCE AND POST-EMERGENCE HERBICIDES HOECHST SCHERING AGREVO GMBH (DE) 1999-07-13 US disclosed