SCHEMBL24914784

SCHEMBL24914784

CCn1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc21

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTOR P42345 20/20 0.79
RICTOR Q6R327 14/20 0.79
RPTOR Q8N122 14/20 0.79
MAPKAP1 Q9BPZ7 14/20 0.79
MLST8 Q9BVC4 14/20 0.79
PIK3CA P42336 13/20 0.70
PIK3CD O00329 5/20 0.58
PIK3CG P48736 5/20 0.58
PRKDC P78527 2/20 0.58
DDR1 Q08345 2/20 0.58
PIK3CB P42338 4/20 0.57
ABL1 P00519 2/20 0.57
PIK3C3 Q8NEB9 1/20 0.55

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
SCHEMBL22494282 0.88 MTOR (1.00) MTORRICTORRPTORMAPKAP1MLST8
SCHEMBL22494321 0.88 MTOR (0.83) MTORRICTORRPTORMAPKAP1MLST8
SCHEMBL29201811 0.87 MTOR (0.75) MTORRICTORRPTORMAPKAP1MLST8
SCHEMBL30880103 0.87 MTOR (0.75) MTORRICTORRPTORMAPKAP1MLST8
SCHEMBL26570080 0.86 MTOR (0.72) MTORRICTORRPTORMAPKAP1MLST8
SCHEMBL22494407 0.85 MTOR (0.82) MTORRICTORRPTORMAPKAP1MLST8
SCHEMBL22494431 0.85 MTOR (0.82) MTORRICTORRPTORMAPKAP1MLST8
SCHEMBL30382307 0.85 MTOR (0.82) MTORRICTORRPTORMAPKAP1MLST8
SCHEMBL22494263 0.85 MTOR (1.00) MTORRICTORRPTORMAPKAP1MLST8
SCHEMBL22494343 0.84 MTOR (0.75) MTORRICTORRPTORMAPKAP1MLST8

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-2023285926-A1 SYNTHESIS OF CHIRAL SUBSTITUTED PYRAZOLOPYRIMIDINE COMPOUNDS Galderma Holding SA (CH) 2023-01-19 WO disclosed