SCHEMBL4960787

SCHEMBL4960787

COc1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2)c2c1CC(N1CCCC1)CC2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.48
HSD17B2 P37059 1/20 0.48
HTR6 P50406 1/20 0.46
QRFPR Q96P65 1/20 0.46
LMNA P02545 5/20 0.45
ALDH1A1 P00352 3/20 0.45
THRB P10828 2/20 0.45
KMT2A Q03164 2/20 0.45
HTT P42858 2/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 1/20 0.44
CCR4 P51679 1/20 0.42
FABP4 P15090 1/20 0.41
FKBP1A P62942 1/20 0.41
GAA P10253 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TRIM24 O15164 1/20 0.40
BRPF1 P55201 1/20 0.40

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
SCHEMBL4522637 1.00 HSD11B1 (0.48) HSD11B1HSD17B2HTR6QRFPRLMNA
SCHEMBL4527076 0.92 THRB (0.56) HSD11B1HSD17B2HTR6QRFPRLMNA
SCHEMBL4513802 0.87 HTR6 (0.53) HSD11B1HSD17B2HTR6QRFPRLMNA
SCHEMBL4519556 0.86 HTR6 (0.48) HSD11B1HSD17B2HTR6QRFPRLMNA
SCHEMBL4520356 0.86 HTR6 (0.52) HSD11B1HSD17B2HTR6QRFPRLMNA
SCHEMBL4524885 0.85 HSD11B1 (0.52) HSD11B1HSD17B2HTR6QRFPRLMNA
SCHEMBL4522172 0.84 GAA (0.56) HSD11B1HSD17B2HTR6QRFPRLMNA
SCHEMBL4514313 0.84 ADRA1A (0.51) HSD11B1HSD17B2HTR6QRFPRLMNA
SCHEMBL4511657 0.84 THRB (0.53) HSD11B1HSD17B2HTR6QRFPRLMNA
SCHEMBL4512103 0.83 HSD11B1 (0.52) HSD11B1HSD17B2HTR6QRFPRLMNA

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-1888518-A1 NOVEL 8-SULFONYL-3 AMINOSUBSTITUTED CHROMAN OR TETRAHYDRONAPHTALENE DERIVATIVES MODULATING THE 5HT6 RECEPTOR AstraZeneca AB (SE) 2008-02-20 EP disclosed
WO-2006126938-A1 NOVEL 8-SULFONYL-3 AMINOSUBSTITUTED CHROMAN OR TETRAHYDRONAPHTALENE DERIVATIVES MODULATING THE 5HT6 RECEPTOR ASTRAZENECA AB (SE) 2006-11-30 WO disclosed