SCHEMBL6989653

SCHEMBL6989653

CCCCC=CC[C@H](O)CNS(=O)(=O)c1ccc(Br)s1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
MAPK1 P28482 1/20 0.44
MAPT P10636 1/20 0.41
HTT P42858 2/20 0.40
GALR3 O60755 1/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
TSHR P16473 3/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
RECQL P46063 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 2/20 0.39
GAA P10253 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
SCHEMBL6989103 1.00 SMN1; SMN2 (0.44) SMN1; SMN2MAPK1MAPTHTTGALR3
SCHEMBL6992708 0.86 KMT2A (0.54) SMN1; SMN2MAPTHTTTSHRMEN1
SCHEMBL6982351 0.86 KMT2A (0.54) SMN1; SMN2MAPTHTTTSHRMEN1
SCHEMBL6989125 0.81 SMN1; SMN2 (0.48) SMN1; SMN2MAPK1MAPTHTTGALR3
SCHEMBL6988109 0.81 ALDH1A1 (0.47) SMN1; SMN2MAPTLMNATSHRMEN1
SCHEMBL6987781 0.69 KMT2A (0.52) SMN1; SMN2MAPTHTTLMNATSHR
SCHEMBL6985299 0.69 KMT2A (0.52) SMN1; SMN2MAPTHTTLMNATSHR
SCHEMBL6983129 0.68 SMN1; SMN2 (0.42) SMN1; SMN2MAPK1MAPTHTTGALR3
SCHEMBL6988643 0.68 SMN1; SMN2 (0.49) SMN1; SMN2MAPK1MAPTHTTGALR3
SCHEMBL6982415 0.67 KMT2A (0.66) SMN1; SMN2MAPTHTTTSHRMEN1

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-1341779-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2003-09-10 EP claimed
WO-2002057252-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2002-07-25 WO claimed