SCHEMBL27116705

SCHEMBL27116705

COc1cccc(-c2ccnc(Nc3ccccc3)n2)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 6/20 0.73
PIK3CA P42336 5/20 0.73
PIK3CB P42338 5/20 0.73
CDK5 Q00535 2/20 0.68
MEN1 O00255 1/20 0.68
NPC1 O15118 1/20 0.68
RAB9A P51151 1/20 0.68
KMT2A Q03164 1/20 0.68
CDK5R1 Q15078 1/20 0.68
EGFR P00533 2/20 0.60
SYK P43405 1/20 0.60
ABL1 P00519 1/20 0.59
PRKCA P17252 1/20 0.59
PRKCD Q05655 1/20 0.59
MTOR P42345 1/20 0.59
SMG1 Q96Q15 1/20 0.59
DYRK1A Q13627 2/20 0.59
CLK4 Q9HAZ1 2/20 0.59
DYRK1B Q9Y463 1/20 0.59
MKNK1 Q9BUB5 1/20 0.58

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
SCHEMBL27116598 0.93 PIK3CG (0.83) PIK3CGPIK3CAPIK3CBCDK5MEN1
SCHEMBL4735284 0.89 PLK1 (0.70) PIK3CGPIK3CAPIK3CBCDK5MEN1
SCHEMBL27116597 0.88 PIK3CG (0.73) PIK3CGPIK3CAPIK3CBCDK5MEN1
SCHEMBL4785619 0.88 PIK3CG (0.70) PIK3CGPIK3CAPIK3CBCDK5MEN1
SCHEMBL4735972 0.88 PIK3CG (0.78) PIK3CGPIK3CAPIK3CBCDK5MEN1
SCHEMBL2942460 0.86 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBCDK5MEN1
SCHEMBL14169345 0.86 PIK3CG (0.67) PIK3CGPIK3CAPIK3CBCDK5MEN1
SCHEMBL2939794 0.85 CDK5 (0.80) PIK3CGPIK3CAPIK3CBCDK5MEN1
SCHEMBL6977138 0.85 ZAP70 (0.73) PIK3CGPIK3CAPIK3CBCDK5MEN1
SCHEMBL12275354 0.85 PIK3CG (0.67) PIK3CGPIK3CAPIK3CBCDK5MEN1

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