SCHEMBL4974288

SCHEMBL4974288

OCC1COCCN1c1nc(Cl)nc(Cl)c1F

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.37
SCN9A Q15858 1/20 0.37
PIK3R1 P27986 3/20 0.36
PIK3CA P42336 3/20 0.36
MTOR P42345 5/20 0.36
PDK1 Q15118 1/20 0.35
JAK2 O60674 4/20 0.33
TYK2 P29597 4/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
MAP4K1 Q92918 1/20 0.32

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
SCHEMBL4974284 1.00 FPR2 (0.37) FPR2SCN9APIK3R1PIK3CAMTOR
SCHEMBL9937466 0.85 PDK1 (0.35) FPR2SCN9APIK3R1PIK3CAMTOR
SCHEMBL9937328 0.81 SMN1; SMN2 (0.37) FPR2SCN9APIK3R1PIK3CAMTOR
SCHEMBL22759089 0.80 MTOR (0.50) PIK3R1PIK3CAMTOR
SCHEMBL22759261 0.80 MTOR (0.50) PIK3R1PIK3CAMTOR
SCHEMBL4974339 0.79 MTOR (0.34) MTOR
SCHEMBL4974343 0.79 MTOR (0.34) MTOR
SCHEMBL17465731 0.78 IRAK4 (0.37) FPR2SCN9APIK3R1PIK3CAMTOR
SCHEMBL16914042 0.76 PIK3CA (0.40) FPR2SCN9APIK3R1PIK3CAMTOR
SCHEMBL16914276 0.76 PIK3CA (0.40) FPR2SCN9APIK3R1PIK3CAMTOR

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-2008132502-A1 PYRAZOLYL-AMINO-SUBSTITUTED PYRIMIDINES AND THEIR USE FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-11-06 WO disclosed