SCHEMBL9819399

SCHEMBL9819399

COC(=O)c1cc2c(S(=O)(=O)Cl)cc(Cl)c(Cl)c2o1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
CTPS1 P17812 1/20 0.36
ALDH1A1 P00352 4/20 0.35
HTT P42858 3/20 0.35
KDM4E B2RXH2 4/20 0.35
TSHR P16473 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
PDE4A P27815 2/20 0.32
PDE4B Q07343 2/20 0.32
PDE4C Q08493 2/20 0.32
PDE4D Q08499 2/20 0.32
LMNA P02545 1/20 0.32
ALOX12 P18054 1/20 0.32
POLB P06746 1/20 0.32
GFER P55789 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL9819208 0.86 TSHR (0.40) MAPTCTPS1ALDH1A1TSHRSMN1; SMN2
SCHEMBL10646339 0.77 LMNA (0.46) MAPTALDH1A1HTTKDM4ETSHR
SCHEMBL9819188 0.73 DAO (0.38) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL26144884 0.72 MAPT (0.47) MAPTALDH1A1HTTKDM4ETSHR
SCHEMBL9819407 0.72 SMN1; SMN2 (0.34) MAPTCTPS1ALDH1A1KDM4ETSHR
SCHEMBL27185630 0.70 MAPT (0.40) MAPTALDH1A1HTTKDM4ESMN1; SMN2
SCHEMBL9818958 0.70 MCL1 (0.40) MAPTALDH1A1TSHR
SCHEMBL9818989 0.70 MAPT (0.41) MAPTALDH1A1HTTKDM4ETSHR
SCHEMBL21798603 0.68 GAA (0.46) MAPTCTPS1ALDH1A1HTTKDM4E
SCHEMBL23461897 0.68 MAPT (0.42) MAPTALDH1A1HTTKDM4ETSHR

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
EP-0312338-B1 SULFAMOYL-2-BENZOFURANCARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND USE SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1991-12-27 EP disclosed
US-4918206-A DIURETICS, HYPOTENSIVE AGENTS; SIDE EFFECT REDUCTION SHIONOGI & CO., LTD. (JP) 1990-04-17 US disclosed
EP-0312338-A1 Sulfamoyl-2-benzofurancarboxylic acid derivatives, their preparation and use SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1989-04-19 EP disclosed