SCHEMBL10146736

SCHEMBL10146736

CS(=O)(=O)c1nc[nH]c1N

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 1/20 0.35
GDA Q9Y2T3 1/20 0.32
HRH2 P25021 1/20 0.31
HRH1 P35367 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL9959924 0.78 TNNI3K (0.36)
SCHEMBL9959605 0.78 ALDH1A1 (0.33)
SCHEMBL25846913 0.77 GABRR1 (0.39) HRH2HRH1HRH4HRH3TDP1
SCHEMBL9960250 0.74 MEN1 (0.32)
SCHEMBL10146748 0.69 KDM4E (0.37) TDP1
SCHEMBL11415123 0.68 HIF1A (0.34) CYP1A2CYP2C19HSD17B10
SCHEMBL31631668 0.65 GABRR1 (0.37) HRH2HRH1HRH4HRH3TDP1
SCHEMBL11415127 0.64 HIF1A (0.54) HRH4CYP1A2HSD17B10
SCHEMBL5634287 0.64
SCHEMBL18229967 0.64 GLP1R (0.41) GLP1RHRH4

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-2012085501-A1 8 - SULFO - IMIDAZOTETRAZIN- 4 - ONE COMPOUNDS AND THEIR USE AS ANTICANCER DRUG PHARMINOX LIMITED (GB) 2012-06-28 WO disclosed