SCHEMBL7694568

SCHEMBL7694568

CCOc1ccccc1CNc1oc(-c2ccccc2C)nc1S(=O)(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
KDM4E B2RXH2 5/20 0.54
HTT P42858 1/20 0.54
MAPK1 P28482 2/20 0.51
HPGD P15428 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
UBE2N P61088 1/20 0.50
KMT2A Q03164 2/20 0.48
GAA P10253 2/20 0.48
MAPT P10636 7/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 1/20 0.47
TP53 P04637 2/20 0.46
RAB9A P51151 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL7702477 0.90 ALDH1A1 (0.55) ALDH1A1KDM4EHTTMAPK1HPGD
SCHEMBL7700906 0.88 ALDH1A1 (0.61) ALDH1A1KDM4EHTTMAPK1HPGD
SCHEMBL7694406 0.87 ALDH1A1 (0.52) ALDH1A1KDM4EHTTMAPK1KMT2A
SCHEMBL7695048 0.83 ALDH1A1 (0.66) ALDH1A1KDM4EHTTHPGDKMT2A
SCHEMBL7695265 0.83 UBE2N (0.56) ALDH1A1KDM4EHTTMAPK1HPGD
SCHEMBL7697517 0.82 ALDH1A1 (0.70) ALDH1A1KDM4EHTTKMT2AGAA
SCHEMBL7696767 0.82 ALDH1A1 (0.55) ALDH1A1KDM4EHTTMAPK1HPGD
SCHEMBL7695104 0.82 ALDH1A1 (0.58) ALDH1A1KDM4EHTTMAPK1HPGD
SCHEMBL7701852 0.80 MAPT (0.51) ALDH1A1KDM4EHTTMAPK1HPGD
SCHEMBL7700945 0.80 ALDH1A1 (0.60) ALDH1A1KDM4EHTTMAPK1HPGD

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-2002100842-A1 SULFONYLOXAZOLAMINES AND THEIR USE AS 5-HT6 LIGANDS MERCK PATENT GMBH (DE) 2002-12-19 WO disclosed