SCHEMBL4782487

SCHEMBL4782487

O=S(=O)(NCCN1CCCCC1)c1cn(S(=O)(=O)c2ccccc2)c2cccc(Cl)c12

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.48
SIGMAR1 Q99720 6/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
SFRP1 Q8N474 1/20 0.42
CHEK1 O14757 1/20 0.41
WEE1 P30291 1/20 0.41
MAPT P10636 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
SCHEMBL14209100 0.88 SIGMAR1 (0.43) HTR6SIGMAR1ALOX15TSHRSFRP1
SCHEMBL4780973 0.85 SIGMAR1 (0.41) HTR6SIGMAR1ALOX15TSHRSFRP1
SCHEMBL14208706 0.78 TSHR (0.44) HTR6TSHR
SCHEMBL4783073 0.78 HTR6 (0.45) HTR6
SCHEMBL4784579 0.78 TDP1 (0.54) HTR6TSHRMAPT
SCHEMBL4781064 0.78 HTR6 (0.43) HTR6TSHRMAPT
SCHEMBL4785064 0.76 TSHR (0.48) HTR6TSHR
SCHEMBL4781621 0.76 HTR6 (0.41) HTR6TSHR
SCHEMBL4783164 0.76 TSHR (0.42) HTR6TSHR
SCHEMBL4783865 0.76 TBXAS1 (0.48)

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
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO claimed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed