SCHEMBL16339840

SCHEMBL16339840

Cc1sc2ncnc(SCC(=O)NO)c2c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 7/20 1.00
CSNK2A2 P19784 2/20 0.74
CSNK2B P67870 2/20 0.74
CSNK2A1 P68400 2/20 0.74
HPGD P15428 3/20 0.72
KMT2A Q03164 3/20 0.72
KDM4E B2RXH2 2/20 0.72
MEN1 O00255 2/20 0.72
SMN1; SMN2 Q16637 1/20 0.72
RXFP1 Q9HBX9 2/20 0.67
NPSR1 Q6W5P4 1/20 0.67
L3MBTL1 Q9Y468 2/20 0.65
TDP1 Q9NUW8 2/20 0.65
POLB P06746 1/20 0.65
CTDSP1 Q9GZU7 1/20 0.64

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
SCHEMBL16339247 0.90 NOTUM (1.00) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD
SCHEMBL16333306 0.85 NOTUM (1.00) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD
SCHEMBL16333328 0.84 NOTUM (1.00) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD
SCHEMBL16339846 0.84 NOTUM (0.81) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD
SCHEMBL16339818 0.84 NOTUM (1.00) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD
SCHEMBL16333449 0.83 NOTUM (0.74) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD
SCHEMBL16338969 0.82 NOTUM (0.69) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD
SCHEMBL452479 0.82 NOTUM (0.69) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD
SCHEMBL16339474 0.81 NPSR1 (1.00) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD
SCHEMBL16339371 0.80 L3MBTL1 (0.66) NOTUMCSNK2A2CSNK2BCSNK2A1HPGD

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
EP-2616471-B1 INHIBITORS OF NOTUM PECTINACETYLESTERASE AND METHODS OF THEIR USE LEXICON PHARMACEUTICALS INC (US) 2014-12-31 EP disclosed