SCHEMBL9819224

SCHEMBL9819224

CCN(CC)S(=O)(=O)c1cc(Cl)c(Cl)c2c(C(=O)O)occ12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.49
KMT2A Q03164 2/20 0.49
NPSR1 Q6W5P4 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 6/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.38
ALDH1A1 P00352 6/20 0.38
LMNA P02545 3/20 0.38
MAPK1 P28482 2/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL9818966 0.87 MCL1 (0.39) SMN1; SMN2KMT2ATSHRMEN1POLB
SCHEMBL9819197 0.80 APP (0.40) KMT2ATSHRKDM4EMEN1POLB
SCHEMBL9819158 0.75 SMN1; SMN2 (0.49) SMN1; SMN2KMT2ANPSR1GAAHPGD
SCHEMBL9819221 0.74 TSHR (0.39) SMN1; SMN2TSHRCYP1A2CYP2C19POLB
SCHEMBL11670492 0.70 SMN1; SMN2 (0.50) SMN1; SMN2KMT2ANPSR1TSHRCYP1A2
SCHEMBL9819164 0.70 SMN1; SMN2 (0.43) SMN1; SMN2KMT2ANPSR1GAAHPGD
SCHEMBL9819407 0.69 SMN1; SMN2 (0.34) SMN1; SMN2NPSR1GAAHPGDTSHR
SCHEMBL4716499 0.67 SMN1; SMN2 (0.62) SMN1; SMN2KMT2ANPSR1TSHRCYP1A2
SCHEMBL11508791 0.66 MCOLN3 (0.47) SMN1; SMN2KMT2ANPSR1TSHRCYP1A2
SCHEMBL11688661 0.66 MCOLN3 (0.47) SMN1; SMN2KMT2ANPSR1TSHRCYP1A2

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
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 claimed
US-4918206-A DIURETICS, HYPOTENSIVE AGENTS; SIDE EFFECT REDUCTION SHIONOGI & CO., LTD. (JP) 1990-04-17 US claimed