SCHEMBL27667448

SCHEMBL27667448

C=CC(N1CCN(C)CC1)S(=O)(=O)c1cnc(N)s1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.36
SLC6A3 Q01959 1/20 0.36
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 2/20 0.31
HRH4 Q9H3N8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL27859237 0.87 ADORA3 (0.40) ADORA3SLC6A3ALDH1A1
SCHEMBL27718942 0.79 KDM4E (0.43) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL28761626 0.75 MAPK1 (0.31)
SCHEMBL998820 0.73 HTT (0.51) ADORA3SLC6A3ALDH1A1MEN1KMT2A
SCHEMBL27593641 0.72 ALDH1A1 (0.39) TDP1ALDH1A1KDM4EKMT2A
SCHEMBL27951598 0.69 CHRM2 (0.36) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL27788104 0.69 CHRM2 (0.50) ADORA3SLC6A3TDP1KDM4E
SCHEMBL27669965 0.68 ADRA2C (0.42) TDP1ALDH1A1
SCHEMBL27593507 0.67 CHRM2 (0.39) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL27845916 0.67 SMN1; SMN2 (0.40) ALDH1A1KDM4EMEN1KMT2A

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
CN-1910166-A Heteroaryl ureas and their use as glucokinase activators NOVO NORDISK AS (DK) 2007-02-07 CN disclosed