SCHEMBL21865574

SCHEMBL21865574

COC(=O)c1cc(F)c(S(=O)(=O)Cl)cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.47
HSD17B10 Q99714 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
HPGD P15428 1/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA9 Q16790 3/20 0.39
CA5A P35218 1/20 0.39
CDK1 P06493 1/20 0.38
KCNH2 Q12809 1/20 0.36
ABL1 P00519 1/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ACLY P53396 2/20 0.35
CA12 O43570 2/20 0.35
CA7 P43166 2/20 0.35
CA14 Q9ULX7 2/20 0.35
ENPP2 Q13822 1/20 0.35
PDK2 Q15119 1/20 0.35

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
SCHEMBL29835245 1.00 PKM (0.47) PKMHSD17B10ALDH1A1TSHRHPGD
SCHEMBL15464809 0.93 PKM (0.42) PKMHSD17B10ALDH1A1TSHRHPGD
SCHEMBL20449571 0.87 GAA (0.43) PKMHSD17B10ALDH1A1TSHRHPGD
SCHEMBL18982096 0.84 MAPT (0.45) ALDH1A1TSHRHPGDCA1CA2
SCHEMBL29991315 0.83 SOS1 (0.40) PKMHSD17B10ALDH1A1TSHRHPGD
SCHEMBL522786 0.82 CA12 (0.47) HSD17B10ALDH1A1TSHRHPGDCA1
SCHEMBL20501221 0.81 POLB (0.43) PKMHSD17B10ALDH1A1TSHRHPGD
SCHEMBL19682396 0.81 GAA (0.42) PKMHSD17B10ALDH1A1TSHRHPGD
SCHEMBL20501201 0.80 SIRT6 (0.45) PKMHSD17B10ALDH1A1TSHRHPGD
SCHEMBL20501193 0.80 CFTR (0.38) PKMHSD17B10ALDH1A1TSHRHPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110885319-B Sulfonamide compounds as sodium channel blockers and uses thereof 成都康弘药业集团股份有限公司 2022-08-12 CN disclosed
WO-2020052509-A1 SULFONAMIDE COMPOUND SERVING AS SODIUM CHANNEL BLOCKER AND USES THEREOF 成都康弘药业集团股份有限公司 2020-03-19 WO disclosed
WO-2020052509-A1 SULFONAMIDE COMPOUND SERVING AS SODIUM CHANNEL BLOCKER AND USES THEREOF 成都康弘药业集团股份有限公司 2020-03-19 WO disclosed
CN-110885319-A Sulfonamide compounds as sodium channel blockers and uses thereof 成都康弘药业集团股份有限公司 2020-03-17 CN disclosed