SCHEMBL4053916

SCHEMBL4053916

CCN(CC)CCN(CC)S(=O)(=O)c1cccc(C(=O)C=CN(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
MAPT P10636 4/20 0.48
GAA P10253 2/20 0.48
HTT P42858 2/20 0.48
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
TSHR P16473 3/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HSD17B10 Q99714 1/20 0.46
POLB P06746 1/20 0.45
RECQL P46063 1/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
RAB9A P51151 2/20 0.44
P4HB P07237 1/20 0.43
SERPINE1 P05121 1/20 0.43
HSP90AA1 P07900 1/20 0.43

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
SCHEMBL4053914 1.00 ALDH1A1 (0.48) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL4060524 0.82 ALDH1A1 (0.55) ALDH1A1MAPTGAAHTTSMN1; SMN2
SCHEMBL4055383 0.80 ALDH1A1 (0.60) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL4055382 0.80 ALDH1A1 (0.60) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL4049726 0.79 MAPT (0.52) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL4049720 0.79 MAPT (0.52) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL5480229 0.74 BCHE (0.62) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL1884750 0.74 ALDH1A1 (0.53) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL1884748 0.74 ALDH1A1 (0.53) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL4237644 0.73 ALDH1A1 (0.51) ALDH1A1MAPTGAAHTTHPGD

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009111260-A1 PHENYLSULFONAMIDE-SUBSTITUTED, PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-11 WO disclosed