SCHEMBL28717153

SCHEMBL28717153

CCCNS(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.64
CA9 Q16790 2/20 0.64
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
GPR55 Q9Y2T6 1/20 0.61
MMP2 P08253 3/20 0.60
MMP9 P14780 3/20 0.60
MMP12 P39900 3/20 0.60
MMP1 P03956 2/20 0.60
GAA P10253 2/20 0.60
ALDH1A1 P00352 5/20 0.57
LMNA P02545 4/20 0.57
KDM4E B2RXH2 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
HPGD P15428 2/20 0.57
NPC1 O15118 1/20 0.57
MAPT P10636 1/20 0.57
RAB9A P51151 1/20 0.57
HDAC1 Q13547 1/20 0.56
HDAC2 Q92769 1/20 0.56

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
SCHEMBL28719368 0.92 CA12 (0.58) CA12CA9CA1CA2GPR55
SCHEMBL22558823 0.90 ALDH1A1 (0.63) CA12CA9CA1CA2GPR55
SCHEMBL301798 0.89 ALDH1A1 (0.68) CA12CA9CA1CA2GAA
SCHEMBL2930825 0.88 ALDH1A1 (0.64) CA12CA9MMP2MMP9MMP12
Hydrochloric Acid SCHEMBL7362553 0.87 ALDH1A1 (0.66) CA12CA9CA1CA2GAA
Hydrochloric Acid SCHEMBL12481388 0.87 ALDH1A1 (0.66) CA12CA9CA1CA2GAA
SCHEMBL7066933 0.85 MMP1 (0.64) MMP2MMP9MMP12MMP1GAA
SCHEMBL14369569 0.83 CA12 (0.49) CA12CA9CA1CA2GPR55
SCHEMBL26214431 0.82 CA12 (0.55) CA12CA9CA1CA2GPR55
SCHEMBL29909105 0.82 MMP2 (0.65) MMP2MMP9MMP12MMP1GAA

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
CN-113527152-A Biphenylsulfonamide compound and method for preventing and treating crop pests by using same 西北农林科技大学 2021-10-22 CN claimed
CN-113527152-A Biphenylsulfonamide compound and method for preventing and treating crop pests by using same 西北农林科技大学 2021-10-22 CN disclosed