SCHEMBL4635927

SCHEMBL4635927

O=C(O)/C=C/c1ccc([N+](=O)[O-])c(CS(=O)(=O)c2cccc3ccccc23)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
ALDH1A1 P00352 4/20 0.44
MAPK1 P28482 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
AKR1C3 P42330 2/20 0.41
AKR1C2 P52895 2/20 0.41
HTT P42858 1/20 0.40
POLB P06746 3/20 0.40
SNCA P37840 1/20 0.40
HDAC1 Q13547 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
PLA2G4A P47712 1/20 0.39
GPR183 P32249 1/20 0.38
GAA P10253 1/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL4635932 1.00 MAPT (0.44) MAPTALDH1A1MAPK1L3MBTL1AKR1C3
SCHEMBL3530886 0.88 ALDH1A1 (0.46) MAPTALDH1A1MAPK1L3MBTL1POLB
SCHEMBL3531827 0.85 ALDH1A1 (0.42) MAPTALDH1A1MAPK1HTTPOLB
SCHEMBL3530892 0.84 ALDH1A1 (0.42) MAPTALDH1A1MAPK1L3MBTL1AKR1C3
SCHEMBL3530887 0.84 ALDH1A1 (0.42) MAPTALDH1A1MAPK1L3MBTL1AKR1C3
SCHEMBL3530890 0.84 ALDH1A1 (0.42) MAPTALDH1A1MAPK1L3MBTL1AKR1C3
SCHEMBL4636830 0.84 POLB (0.53) MAPTALDH1A1MAPK1L3MBTL1HTT
SCHEMBL4636829 0.84 POLB (0.53) MAPTALDH1A1MAPK1L3MBTL1HTT
SCHEMBL3534757 0.78 ALDH1A1 (0.43) MAPTALDH1A1MAPK1HTTPOLB
SCHEMBL1814309 0.78 ALDH1A1 (0.43) MAPTALDH1A1MAPK1HTTPOLB

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-1931640-A2 SUBSTITUTED-3-SULFONYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth a Corporation of the State of Delaware (US) 2008-06-18 EP disclosed
WO-2007021711-A2 SUBSTITUTED-3-SULFONYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2007-02-22 WO disclosed