SCHEMBL18929978

SCHEMBL18929978

CNC(=O)c1cnc(Cl)cc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 2/20 0.41
TYK2 P29597 5/20 0.40
JAK2 O60674 4/20 0.40
JAK1 P23458 4/20 0.40
JAK3 P52333 3/20 0.40
SCN9A Q15858 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40
SCN10A Q9Y5Y9 1/20 0.40
PIK3C3 Q8NEB9 1/20 0.37
NUDT1 P36639 2/20 0.37
PTPN11 Q06124 1/20 0.37
CASP1 P29466 1/20 0.37
ABL1 P00519 1/20 0.37
BRAF P15056 1/20 0.36
HDAC1 Q13547 1/20 0.36
PDE10A Q9Y233 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35

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
SCHEMBL7454261 0.86 SCN10A (0.40) NNMTTYK2JAK2JAK1JAK3
SCHEMBL31278662 0.86 SCN10A (0.40) NNMTTYK2JAK2JAK1JAK3
SCHEMBL30392436 0.82 NNMT (0.47) NNMTTYK2JAK2JAK1JAK3
SCHEMBL15688822 0.82 NNMT (0.47) NNMTTYK2JAK2JAK1JAK3
SCHEMBL25544448 0.82 CSNK1D (0.43) TYK2JAK2JAK1JAK3
SCHEMBL17796856 0.81 NNMT (0.44) NNMTTYK2JAK2JAK1JAK3
SCHEMBL26765951 0.80 GABRP (0.38) NNMTABL1
SCHEMBL17796149 0.80 SIRT6 (0.39) NNMTABL1
SCHEMBL22291639 0.79 USP2 (0.38) NNMTTYK2JAK2JAK1JAK3
SCHEMBL29977172 0.79 ABL1 (0.56) CASP1ABL1

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-2922841-B1 ALKYL-AMIDE-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2017-06-07 EP disclosed