SCHEMBL29909866

SCHEMBL29909866

CCC#Cc1nnc2nc(N(C)c3ccccc3)c3ccccc3n12

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 2/20 0.37
EGFR P00533 4/20 0.33
CDK2 P24941 1/20 0.33
GSK3B P49841 1/20 0.33
DYRK1A Q13627 1/20 0.33
ABCG2 Q9UNQ0 2/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
PDGFRB P09619 3/20 0.32
KDR P35968 3/20 0.32

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
SCHEMBL30978997 0.90 PDE5A (0.36) PDE5AEGFRCDK2GSK3BDYRK1A
SCHEMBL30979109 0.84 PDE5A (0.37) PDE5AEGFRCDK2GSK3BDYRK1A
SCHEMBL29909864 0.83 PDE5A (0.40) PDE5AEGFRCDK2GSK3BDYRK1A
SCHEMBL29210703 0.83 PDE5A (0.40) PDE5AEGFRCDK2GSK3BDYRK1A
SCHEMBL30979037 0.83 PDE5A (0.36) PDE5AEGFRCDK2GSK3BDYRK1A
SCHEMBL29909388 0.80 ABCG2 (0.40) ABCG2
SCHEMBL30979027 0.80 PDE5A (0.41) PDE5AEGFR
SCHEMBL30979143 0.77 PDE5A (0.41) PDE5AEGFRCDK2GSK3BDYRK1A
SCHEMBL30979122 0.77 PDE5A (0.43) PDE5AEGFRABCG2CSNK2A2CSNK2B
SCHEMBL30978980 0.77 PDE5A (0.43) PDE5AEGFRCDK2GSK3BDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 CN disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed