SCHEMBL27713085

SCHEMBL27713085

CC(F)C(O)c1ncccc1S(N)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.44
CA2 P00918 5/20 0.44
CA9 Q16790 3/20 0.44
MAPK1 P28482 1/20 0.44
FTO Q9C0B1 1/20 0.41
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 3/20 0.38
TRPV4 Q9HBA0 1/20 0.37
AR P10275 1/20 0.36
APLNR P35414 1/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
CA5A P35218 2/20 0.33
CA4 P22748 2/20 0.33
CA6 P23280 2/20 0.33

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
SCHEMBL31028705 0.82 CA2 (0.53) CA1CA2CA9MAPK1FTO
SCHEMBL578800 0.82 CA1 (0.53) CA1CA2CA9MAPK1FTO
SCHEMBL27801399 0.81 CA1 (0.49) CA1CA2CA9MAPK1FTO
SCHEMBL6574265 0.80 ALOX5AP (0.38) CA1CA2CA9LMNATRPV4
SCHEMBL8105741 0.78 CA1 (0.38) CA1CA2CA9MAPK1FTO
SCHEMBL3717781 0.77 CA2 (0.45) CA1CA2CA9MAPK1FTO
SCHEMBL3717326 0.77 CA2 (0.45) CA1CA2CA9MAPK1FTO
SCHEMBL578867 0.77 CA2 (0.45) CA1CA2CA9MAPK1FTO
SCHEMBL6816641 0.75 CA1 (0.36) CA1CA2CA9MAPK1FTO
SCHEMBL6571688 0.73 CA2 (0.35) CA1CA2CA9MAPK1FTO

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
CN-101237770-A Aqueous suspension herbicidal composition ISHIHARA SANGYO KAISHA (JP) 2008-08-06 CN claimed
CN-101237770-B Aqueous suspension herbicidal composition Ishihara Sangyo Kabushiki Kaisha Ltd. (JP) 2012-02-01 CN disclosed
CN-101237770-A Aqueous suspension herbicidal composition ISHIHARA SANGYO KAISHA (JP) 2008-08-06 CN disclosed