SCHEMBL7983833

SCHEMBL7983833

CCn1nc(C)cc1C(=O)NCCOc1cccc(Cn2nc(C)cc2C(=O)N2CCOCC2)c1C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
STING1 Q86WV6 7/20 0.40
KDM4E B2RXH2 2/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NAMPT P43490 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CFTR P13569 1/20 0.36
PIK3CD O00329 1/20 0.36
PIK3R2 O00459 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
PIK3CG P48736 1/20 0.36
PIK3R5 Q8WYR1 1/20 0.36
PIK3R3 Q92569 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 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
SCHEMBL7998166 0.89 STING1 (0.38) MEN1KMT2ASTING1KDM4EL3MBTL1
SCHEMBL7983679 0.83 HPGD (0.40) MEN1KMT2ASTING1KDM4EL3MBTL1
SCHEMBL7997825 0.82 STING1 (0.47) STING1L3MBTL1NPSR1ALDH1A1
SCHEMBL7984304 0.81 STING1 (0.49) STING1L3MBTL1NPSR1ALDH1A1
SCHEMBL7983932 0.80 STING1 (0.42) MEN1KMT2ASTING1KDM4EL3MBTL1
SCHEMBL7995372 0.78 STING1 (0.42) MEN1KMT2ASTING1L3MBTL1
SCHEMBL7998407 0.77 STING1 (0.41) STING1L3MBTL1
SCHEMBL7983874 0.77 STING1 (0.43) STING1KDM4EL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL7994269 0.77 STING1 (0.41) MEN1KMT2ASTING1KDM4EL3MBTL1
SCHEMBL7995743 0.76 STING1 (0.41) MEN1KMT2ASTING1L3MBTL1

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
WO-2001034578-A1 COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY ASTRAZENECA AB (SE) 2001-05-17 WO disclosed