SCHEMBL27116598

SCHEMBL27116598

COc1cccc(Nc2nccc(-c3cccc(OC)c3)n2)c1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 5/20 0.83
PIK3CA P42336 4/20 0.83
PIK3CB P42338 4/20 0.83
EGFR P00533 1/20 0.69
CDK5 Q00535 3/20 0.66
MTOR P42345 1/20 0.66
SMG1 Q96Q15 1/20 0.66
MEN1 O00255 1/20 0.66
NPC1 O15118 1/20 0.66
RAB9A P51151 1/20 0.66
KMT2A Q03164 1/20 0.66
CDK5R1 Q15078 1/20 0.66
SYK P43405 2/20 0.65
DYRK1A Q13627 4/20 0.60
CDK2 P24941 4/20 0.60
GSK3B P49841 3/20 0.60
CDK4 P11802 1/20 0.60
CLK4 Q9HAZ1 2/20 0.60
DYRK1B Q9Y463 1/20 0.60
CCNA2 P20248 1/20 0.59

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
SCHEMBL27116705 0.93 PIK3CG (0.73) PIK3CGPIK3CAPIK3CBEGFRCDK5
SCHEMBL2942460 0.92 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBEGFRCDK5
SCHEMBL27116597 0.91 PIK3CG (0.73) PIK3CGPIK3CAPIK3CBEGFRCDK5
SCHEMBL4785619 0.91 PIK3CG (0.70) PIK3CGPIK3CAPIK3CBEGFRCDK5
SCHEMBL2939794 0.91 CDK5 (0.80) PIK3CGPIK3CAPIK3CBEGFRCDK5
SCHEMBL4735972 0.91 PIK3CG (0.78) PIK3CGPIK3CAPIK3CBEGFRCDK5
SCHEMBL7474612 0.90 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBEGFRCDK5
SCHEMBL8489648 0.90 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBEGFRCDK5
SCHEMBL2324992 0.90 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBEGFRCDK5
SCHEMBL27115896 0.90 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBEGFRCDK5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 WO claimed
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 WO disclosed
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 WO disclosed