SCHEMBL4785654

SCHEMBL4785654

CC(C)c1cccc2c1c(S(=O)(=O)NCCc1cccnc1)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 15/20 0.46
TBXA2R P21731 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL4784929 0.91 ALDH1A1 (0.45) ALDH1A1HTT
SCHEMBL4782569 0.90 TDP1 (0.51) SMN1; SMN2TDP1ALDH1A1HTT
SCHEMBL4780521 0.88 TBXAS1 (0.48) TBXAS1TBXA2RSMN1; SMN2TDP1ALDH1A1
SCHEMBL4781216 0.87 TBXAS1 (0.47) TBXAS1TBXA2RSMN1; SMN2TDP1
SCHEMBL4783865 0.86 TBXAS1 (0.48) TBXAS1TBXA2RSMN1; SMN2TDP1ALDH1A1
SCHEMBL4783444 0.86 TBXAS1 (0.48) TBXAS1TBXA2RSMN1; SMN2TDP1
SCHEMBL4780287 0.85 ALDH1A1 (0.48) TDP1ALDH1A1
SCHEMBL4782361 0.84 TBXAS1 (0.46) TBXAS1TBXA2RSMN1; SMN2TDP1
SCHEMBL4783077 0.84 TBXAS1 (0.46) TBXAS1TBXA2RSMN1; SMN2TDP1
SCHEMBL4782431 0.84 HTT (0.43) TDP1ALDH1A1HTT

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