SCHEMBL27115274

SCHEMBL27115274

Oc1cc(-c2ccnc(Nc3cc(F)cc(F)c3)n2)ccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 2/20 0.50
▸ CDK2 P24941 2/20 0.50
▸ IKBKB O14920 1/20 0.50
▸ PLK1 P53350 4/20 0.49
▸ GSK3B P49841 1/20 0.47
▸ PIK3CA P42336 2/20 0.47
▸ PIK3CG P48736 2/20 0.47
▸ SYK P43405 2/20 0.46
▸ PIK3CB P42338 1/20 0.45
▸ ABL1 P00519 3/20 0.45
▸ BCR P11274 2/20 0.45
▸ SRC P12931 2/20 0.45
▸ CLK1 P49759 1/20 0.44
▸ CLK2 P49760 1/20 0.44
▸ DYRK1A Q13627 1/20 0.44
▸ CLK4 Q9HAZ1 1/20 0.44
▸ DYRK1B Q9Y463 1/20 0.44
▸ PDGFRB P09619 1/20 0.43
▸ PDGFRA P16234 1/20 0.43
▸ CAMK2D Q13557 3/20 0.43

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
SCHEMBL27116472 0.88 CDK2 (0.57) CDK4CDK2PLK1GSK3BPIK3CA
SCHEMBL27115272 0.87 PLK1 (0.47) CDK4CDK2PLK1PIK3CAPIK3CG
SCHEMBL27116134 0.83 GSK3B (0.52) CDK2IKBKBPLK1GSK3BPIK3CA
SCHEMBL27116599 0.82 ABL1 (0.62) CDK2IKBKBPLK1GSK3BPIK3CA
SCHEMBL27115894 0.82 CAMK2D (0.60) PLK1PIK3CAPIK3CGSYKPIK3CB
SCHEMBL27115275 0.81 PIK3CG (0.55) CDK4CDK2IKBKBGSK3BPIK3CA
SCHEMBL27145130 0.80 PLK1 (0.51) PLK1GSK3BPIK3CAPIK3CGPIK3CB
SCHEMBL27115678 0.80 PLK1 (0.49) PLK1ABL1BCRSRCCLK1
SCHEMBL27144622 0.79 ABL1 (0.62) PLK1ABL1BCRSRCPDGFRB
SCHEMBL27154547 0.79 SYK (0.50) PLK1SYKABL1BCRSRC

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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