SCHEMBL27116528

SCHEMBL27116528

COc1cc(-c2ccnc(Nc3cccc(F)c3)n2)ccn1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 5/20 0.64
▸ PIK3CA P42336 4/20 0.64
▸ PIK3CB P42338 3/20 0.57
▸ CDK2 P24941 3/20 0.56
▸ CDK4 P11802 1/20 0.56
▸ MAPT P10636 1/20 0.54
▸ CDK5 Q00535 2/20 0.54
▸ CAMK2D Q13557 1/20 0.52
▸ ABL1 P00519 5/20 0.51
▸ BCR P11274 5/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ CDK5R1 Q15078 1/20 0.51
▸ CDC7 O00311 1/20 0.51
▸ CDK19 Q9BWU1 1/20 0.51
▸ SRC P12931 2/20 0.50
▸ JAK2 O60674 1/20 0.50
▸ FLT3 P36888 1/20 0.50

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
SCHEMBL27115275 0.89 PIK3CG (0.55) PIK3CGPIK3CAPIK3CBCDK2CDK4
SCHEMBL27115445 0.88 PIK3CG (0.66) PIK3CGPIK3CAPIK3CBCDK2MAPT
SCHEMBL27116179 0.87 PIK3CG (0.66) PIK3CGPIK3CAPIK3CBCDK2CDK4
SCHEMBL27115896 0.87 PIK3CG (0.76) PIK3CGPIK3CAPIK3CBCDK2CDK4
SCHEMBL27116600 0.86 ABL1 (0.57) PIK3CGPIK3CAPIK3CBMAPTCDK5
SCHEMBL4735972 0.86 PIK3CG (0.78) PIK3CGPIK3CAPIK3CBCDK2CDK4
SCHEMBL5733563 0.86 MAPT (0.72) PIK3CGPIK3CAPIK3CBCDK2CDK4
SCHEMBL27115273 0.85 PIK3CG (0.51) PIK3CGPIK3CAPIK3CBCDK2MAPT
SCHEMBL27116135 0.84 GSK3B (0.53) PIK3CGPIK3CAPIK3CBCDK2MAPT
SCHEMBL4736185 0.84 PIK3CG (0.80) PIK3CGPIK3CAPIK3CBCDK2CDK4

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
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