SCHEMBL9072653

SCHEMBL9072653

Nc1ncc(SCCC(=O)O)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 2/20 0.47
MYC P01106 1/20 0.42
WDR5 P61964 1/20 0.42
ALDH1A1 P00352 5/20 0.41
CDK2 P24941 3/20 0.41
CSNK2A1 P68400 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
HSD17B10 Q99714 2/20 0.40
POLB P06746 2/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
CSNK2A2 P19784 2/20 0.40
CSNK2B P67870 2/20 0.40
CCNE2 O96020 2/20 0.39
CCNE1 P24864 2/20 0.39
GAA P10253 1/20 0.38
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
NPSR1 Q6W5P4 2/20 0.36

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
SCHEMBL2606389 0.83 MYC (0.44) MYCWDR5CDK2CSNK2A1SMN1; SMN2
SCHEMBL16724105 0.81 SMN1; SMN2 (0.41) MYCWDR5ALDH1A1CDK2SMN1; SMN2
SCHEMBL999731 0.79 SMN1; SMN2 (0.56) ALDH1A1CDK2SMN1; SMN2POLBHPGD
SCHEMBL640218 0.79 MYC (0.47) MYCWDR5ALDH1A1CDK2CSNK2A1
SCHEMBL9094223 0.78 APEX1 (0.42) APEX1ALDH1A1CDK2CSNK2A1SMN1; SMN2
SCHEMBL1025059 0.76 CDK2 (0.47) MYCWDR5ALDH1A1CDK2CSNK2A1
SCHEMBL1025149 0.75 MYC (0.47) MYCWDR5ALDH1A1CDK2CSNK2A1
SCHEMBL13639769 0.74 CCNE1 (0.70) CDK2CCNE2CCNE1
SCHEMBL738352 0.73 CDK2 (0.48) MYCWDR5CDK2CSNK2A1SMN1; SMN2
SCHEMBL9258239 0.72 APEX1 (0.46) APEX1ALDH1A1CSNK2A1SMN1; SMN2HSD17B10

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
EP-2377856-A1 Urea glucokinase activators NOVO NORDISK A/S (DK) 2011-10-19 EP disclosed
WO-2007006760-A1 DICYCLOALKYL UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2007-01-18 WO disclosed