SCHEMBL4783496

SCHEMBL4783496

Cc1cccc2c1c(S(=O)(=O)NCC1CCOCC1)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
PKM P14618 2/20 0.45
ALDH1A1 P00352 2/20 0.45
GBA1 P04062 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTR6 P50406 7/20 0.40
TGFBR1 P36897 2/20 0.40
CNR2 P34972 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL4782615 0.89 NPC1 (0.46) NPC1PKMALDH1A1GBA1MEN1
SCHEMBL4782093 0.88 NPC1 (0.48) NPC1PKMALDH1A1GBA1MEN1
SCHEMBL4782077 0.88 NPC1 (0.44) NPC1PKMALDH1A1GBA1MEN1
SCHEMBL4783430 0.86 CNR2 (0.48) NPC1PKMALDH1A1GBA1HTR6
SCHEMBL4781316 0.85 HTR6 (0.43) ALDH1A1HTR6
SCHEMBL4780971 0.79 BRD4 (0.45) NPC1HTR6
SCHEMBL4783889 0.79 BRD4 (0.43) NPC1HTR6
SCHEMBL4782603 0.75 BRD4 (0.43) ALDH1A1HTR6
SCHEMBL4784291 0.73 TDP1 (0.54) PKMALDH1A1MEN1KMT2AHTR6
SCHEMBL4800128 0.73 HTR6 (0.43) ALDH1A1HTR6

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