SCHEMBL1447567

SCHEMBL1447567

Cc1ncc(-c2ccnc(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)n1CC1CC1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 15/20 0.72
▸ CDK1 P06493 5/20 0.57
▸ BTK Q06187 1/20 0.51
▸ KCNH2 Q12809 3/20 0.49
▸ JAK2 O60674 1/20 0.49
▸ LRRK2 Q5S007 1/20 0.49
▸ PLK4 O00444 1/20 0.49
▸ MAPK10 P53779 1/20 0.46
▸ CDK4 P11802 1/20 0.46

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
SCHEMBL1448559 0.91 CDK2 (0.73) CDK2CDK1KCNH2
SCHEMBL1447162 0.90 CDK2 (0.69) CDK2CDK1BTKKCNH2JAK2
SCHEMBL1447265 0.87 CDK2 (0.69) CDK2CDK1KCNH2
SCHEMBL1448088 0.85 CDK2 (0.66) CDK2CDK1KCNH2
SCHEMBL1447630 0.84 CDK2 (0.69) CDK2CDK1BTKKCNH2JAK2
SCHEMBL1447392 0.82 CDK2 (0.82) CDK2CDK1KCNH2CDK4
SCHEMBL1448568 0.82 CDK2 (0.64) CDK2CDK1KCNH2
SCHEMBL3551699 0.82 CDK2 (0.68) CDK2CDK1BTKKCNH2JAK2
SCHEMBL1447174 0.81 CDK2 (0.61) CDK2CDK1KCNH2LRRK2
SCHEMBL1447113 0.80 CDK2 (0.74) CDK2CDK1KCNH2CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2301928-A1 Imidazolyl-pyrimidine compounds for use in the treatment of proliferative disorders AstraZeneca AB (SE) 2011-03-30 — — EP disclosed
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