SCHEMBL807843

SCHEMBL807843

CNCc1cnc(N)cn1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PI4KA P42356 1/20 0.38
PIK3CG P48736 1/20 0.38
PI4KB Q9UBF8 1/20 0.38
IL6 P05231 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
NOS2 P35228 5/20 0.32
NOS1 P29475 5/20 0.32
NOS3 P29474 4/20 0.32
F2 P00734 4/20 0.32
ADRB2 P07550 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
HSP90AA1 P07900 1/20 0.30

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
SCHEMBL14872317 0.77 PIK3CD (0.33) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL6468950 0.76 MEN1 (0.44) MEN1KMT2AF2
SCHEMBL20019538 0.76 MEN1 (0.41) MEN1KMT2A
SCHEMBL3984933 0.76 CYP1A2 (0.42) MEN1KMT2A
SCHEMBL11960349 0.75 PIK3CD (0.31) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL1725245 0.75
SCHEMBL5132531 0.74 MEN1 (0.42) MEN1KMT2AIL6TLR7NOS2
SCHEMBL24656203 0.72 PIK3CD (0.47) MEN1KMT2APIK3CDPIK3CAPIK3CB
SCHEMBL6468946 0.72 MEN1 (0.41) MEN1KMT2AF2
SCHEMBL6470756 0.71 MEN1 (0.40) MEN1KMT2ANOS2F2

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
WO-2015091584-A1 THIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND THEIR USE AS TYK2 KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2015-06-25 WO disclosed
WO-2012035039-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-03-22 WO disclosed