SCHEMBL4782569

SCHEMBL4782569

CC(C)c1cccc2c1c(S(=O)(=O)NCCc1ccncc1)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
ALDH1A1 P00352 8/20 0.42
LMNA P02545 6/20 0.42
SMN1; SMN2 Q16637 6/20 0.42
HTT P42858 5/20 0.42
HTR6 P50406 2/20 0.42
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 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
SCHEMBL4784929 0.93 ALDH1A1 (0.45) ALDH1A1LMNAHTTHTR6L3MBTL1
SCHEMBL4785654 0.90 TBXAS1 (0.46) TDP1ALDH1A1SMN1; SMN2HTT
SCHEMBL4784291 0.87 TDP1 (0.54) TDP1ALDH1A1LMNASMN1; SMN2HTT
SCHEMBL4780287 0.87 ALDH1A1 (0.48) TDP1ALDH1A1HTR6TP53MEN1
SCHEMBL4782431 0.86 HTT (0.43) TDP1ALDH1A1LMNAHTTHTR6
SCHEMBL4784579 0.85 TDP1 (0.54) TDP1ALDH1A1LMNASMN1; SMN2HTT
SCHEMBL4782126 0.83 KEAP1 (0.44) ALDH1A1LMNASMN1; SMN2HTTHTR6
SCHEMBL4783597 0.83 TDP1 (0.51) TDP1ALDH1A1LMNASMN1; SMN2HTT
SCHEMBL4785325 0.83 TDP1 (0.51) TDP1ALDH1A1LMNASMN1; SMN2HTT
SCHEMBL4784239 0.83 MEN1 (0.48) TDP1ALDH1A1LMNASMN1; SMN2HTT

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