SCHEMBL27116134

SCHEMBL27116134

Oc1cc(-c2ccnc(Nc3ccc(F)c(F)c3)n2)ccn1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 7/20 0.52
▸ CDK2 P24941 1/20 0.52
▸ IKBKB O14920 1/20 0.52
▸ CHUK O15111 1/20 0.52
▸ EIF2AK2 P19525 1/20 0.51
▸ PLK1 P53350 5/20 0.50
▸ CLK1 P49759 1/20 0.48
▸ CLK2 P49760 1/20 0.48
▸ DYRK1A Q13627 1/20 0.48
▸ CLK4 Q9HAZ1 1/20 0.48
▸ DYRK1B Q9Y463 1/20 0.48
▸ CAMK2D Q13557 2/20 0.47
▸ ABL1 P00519 1/20 0.46
▸ BCR P11274 1/20 0.46
▸ SRC P12931 1/20 0.46
▸ CSNK2A1 P68400 1/20 0.46
▸ PIK3CA P42336 1/20 0.45
▸ PIK3CG P48736 1/20 0.45

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
SCHEMBL16941489 0.86 ABL1 (0.61) GSK3BCDK2IKBKBCHUKEIF2AK2
SCHEMBL12800930 0.84 PLK1 (0.51) GSK3BCDK2IKBKBCHUKEIF2AK2
SCHEMBL27115274 0.83 CDK4 (0.50) GSK3BCDK2IKBKBPLK1CLK1
SCHEMBL27116472 0.83 CDK2 (0.57) GSK3BCDK2PLK1CLK2DYRK1A
SCHEMBL27116135 0.82 GSK3B (0.53) GSK3BCDK2IKBKBCHUKEIF2AK2
SCHEMBL27115894 0.80 CAMK2D (0.60) PLK1CLK1CLK2DYRK1ACLK4
SCHEMBL27116599 0.80 ABL1 (0.62) GSK3BCDK2IKBKBPLK1CAMK2D
SCHEMBL5733933 0.80 CAMK2D (0.71) CDK2EIF2AK2PLK1CAMK2DABL1
SCHEMBL27154547 0.79 SYK (0.50) PLK1CLK1CLK2DYRK1ACLK4
SCHEMBL27115272 0.79 PLK1 (0.47) CDK2PLK1CLK1CLK2DYRK1A

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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