SCHEMBL7694580

SCHEMBL7694580

CCOc1ccccc1-c1nc(S(=O)(=O)c2ccccc2)c(CN)o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
KMT2A Q03164 1/20 0.52
UBE2N P61088 1/20 0.47
ALDH1A1 P00352 5/20 0.43
TSHR P16473 3/20 0.43
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MAPK1 P28482 2/20 0.42
HSD17B10 Q99714 1/20 0.42
KDM4E B2RXH2 2/20 0.42
PPARG P37231 1/20 0.42
STAT3 P40763 1/20 0.42
NCOA2 Q15596 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
LOX P28300 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL7702731 0.92 MEN1 (0.47) MEN1NPC1KMT2AUBE2NALDH1A1
SCHEMBL7695264 0.91 MEN1 (0.50) MEN1NPC1KMT2AUBE2NALDH1A1
SCHEMBL7696726 0.84 MEN1 (0.45) MEN1NPC1KMT2AUBE2NALDH1A1
SCHEMBL7663107 0.82 ALDH1A1 (0.47) MEN1NPC1KMT2AALDH1A1TSHR
SCHEMBL7694582 0.82 UBE2N (0.69) MEN1NPC1KMT2AUBE2NALDH1A1
SCHEMBL7695265 0.81 UBE2N (0.56) MEN1NPC1KMT2AUBE2NALDH1A1
SCHEMBL7696673 0.78 ALDH1A1 (0.58) MEN1KMT2AUBE2NALDH1A1TSHR
SCHEMBL7701107 0.77 C1R (0.46) MEN1KMT2AALDH1A1TSHRMAPT
SCHEMBL7700431 0.76 TP53 (0.47) MEN1KMT2AALDH1A1TSHRMAPT
SCHEMBL7694684 0.75 TP53 (0.65) MEN1KMT2AALDH1A1TSHRMAPT

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